Compound Q&A
How is 3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide (CAS: 9064-47-5) typically synthesized?
Answer
![3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(4-methylphenyl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(5-methylpyridin-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[3-oxo-1-phenyl-4-(4-piperidin-1-ylphenyl)butan-2-yl]prop-2-enamide;4-[3-[3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoylamino]-2-oxo-4-phenylbutyl]-N,N-dimethylbenzamide](https://static.chemtradehub.com/structs/906/9064-47-5-593c.webp "3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(4-methylphenyl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(5-methylpyridin-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[3-oxo-1-phenyl-4-(4-piperidin-1-ylphenyl)butan-2-yl]prop-2-enamide;4-[3-[3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoylamino]-2-oxo-4-phenylbutyl]-N,N-dimethylbenzamide")
This compound can be synthesized via a multi-step process involving the condensation of a tetrazole derivative with a substituted butanone intermediate. The reaction is typically carried out in the presence of a coupling agent like HATU and a base such as DIPEA. The product is isolated by column chromatography and recrystallization to achieve high purity.
About
CAS No
9064-47-5
English Name
3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(4-methylphenyl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(5-methylpyridin-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[3-oxo-1-phenyl-4-(4-piperidin-1-ylphenyl)butan-2-yl]prop-2-enamide;4-[3-[3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoylamino]-2-oxo-4-phenylbutyl]-N,N-dimethylbenzamide
Molecular Formula
C141H128Cl5N29O11S
Molecular Weight
2614 g/mol
SMILES
CC1=CC=C(C=C1)CC(=O)C(CC2=CC=CC=C2)NC(=O)C=CC3=C(C=CC(=C3)Cl)N4C=NN=N4.CC1=CC2=C(C=C1)N=C(S2)CC(=O)C(CC3=CC=CC=C3)NC(=O)C=CC4=C(C=CC(=C4)Cl)N5C=NN=N5.CC1=CN=C(C=C1)CC(=O)C(CC2=CC=CC=C2)NC(=O)C=CC3=C(C=CC(=C3)Cl)N4C=NN=N4.CN(C)C(=O)C1=CC=C(C=C1)CC(=O)C(CC2=CC=CC=C2)NC(=O)C=CC3=C(C=CC(=C3)Cl)N4C=NN=N4.C1CCN(CC1)C2=CC=C(C=C2)CC(=O)C(CC3=CC=CC=C3)NC(=O)C=CC4=C(C=CC(=C4)Cl)N5C=NN=N5
InChIKey
FPVZEJZSOWQWOV-UHFFFAOYSA-N
Last Updated: 2025-12-29 01:16
![3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(4-methylphenyl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(5-methylpyridin-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[3-oxo-1-phenyl-4-(4-piperidin-1-ylphenyl)butan-2-yl]prop-2-enamide;4-[3-[3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoylamino]-2-oxo-4-phenylbutyl]-N,N-dimethylbenzamide — HePeng （ ShangHai ） Biotechnology Co Ltd](https://static.chemtradehub.com/suppliers/67ceccf22b2de6e8e95a5e0f/67ceccf22b2de6e8e95a5e0f-logo.webp){kind=logo}
![3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(4-methylphenyl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(5-methylpyridin-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[3-oxo-1-phenyl-4-(4-piperidin-1-ylphenyl)butan-2-yl]prop-2-enamide;4-[3-[3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoylamino]-2-oxo-4-phenylbutyl]-N,N-dimethylbenzamide — Nanjing DuLai Biotechnology Co., Ltd.](https://static.chemtradehub.com/suppliers/67ce9ba92b2de6e8e95a48bf/67ce9ba92b2de6e8e95a48bf-logo.webp){kind=logo}
![3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(4-methylphenyl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[4-(5-methylpyridin-2-yl)-3-oxo-1-phenylbutan-2-yl]prop-2-enamide;3-[5-chloro-2-(tetrazol-1-yl)phenyl]-N-[3-oxo-1-phenyl-4-(4-piperidin-1-ylphenyl)butan-2-yl]prop-2-enamide;4-[3-[3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoylamino]-2-oxo-4-phenylbutyl]-N,N-dimethylbenzamide — Shanghai Yuyeh Biotechnology Co., Ltd.](https://static.chemtradehub.com/suppliers/67ce9f132b2de6e8e95a48fe/67ce9f132b2de6e8e95a48fe-logo.webp){kind=logo}