N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[4-(4-bromophenyl)thiazol-2-yl]acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[4-(4-bromophenyl)-2-thiazolyl]acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(4-besylpiperazino)-N-[4-(4-bromophenyl)thiazol-2-yl]acetamide Formula: C21H21BrN4O3S2 MolecularWeight: 521.45044

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H21BrN4O3S2/c22-17-8-6-16(7-9-17)19-15-30-21(23-19)24-20(27)14-25-10-12-26(13-11-25)31(28,29)18-4-2-1-3-5-18/h1-9,15H,10-14H2,(H,23,24,27)