2-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[4-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[4-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]phenyl]ethanamide Openeye Name: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-N-[4-[4-(3-chlorobenzoyl)piperazin-1-yl]phenyl]acetamide CAS Name: 2-[[1-(4-bromophenyl)-5-tetrazolyl]thio]-N-[4-[4-[(3-chlorophenyl)-oxomethyl]-1-piperazinyl]phenyl]acetamide IUPAC Name: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-N-[4-[4-(3-chlorobenzoyl)piperazin-1-yl]phenyl]acetamide Traditional Name: 2-[[1-(4-bromophenyl)tetrazol-5-yl]thio]-N-[4-[4-(3-chlorobenzoyl)piperazino]phenyl]acetamide Formula: C26H23BrClN7O2S MolecularWeight: 612.92852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CSC3=NN=NN3C4=CC=C(C=C4)Br)C(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CSC3=NN=NN3C4=CC=C(C=C4)Br)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C26H23BrClN7O2S/c27-19-4-8-23(9-5-19)35-26(30-31-32-35)38-17-24(36)29-21-6-10-22(11-7-21)33-12-14-34(15-13-33)25(37)18-2-1-3-20(28)16-18/h1-11,16H,12-15,17H2,(H,29,36)