N-[4-[4-(3-bromophenyl)carbonylpiperazin-1-yl]phenyl]-2-(4-methylphenyl)sulfonyl-ethanamide

Systemtic Name: N-[4-[4-(3-bromophenyl)carbonylpiperazin-1-yl]phenyl]-2-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: N-[4-[4-(3-bromobenzoyl)piperazin-1-yl]phenyl]-2-(p-tolylsulfonyl)acetamide CAS Name: N-[4-[4-[(3-bromophenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-(4-methylphenyl)sulfonylacetamide IUPAC Name: N-[4-[4-(3-bromobenzoyl)piperazin-1-yl]phenyl]-2-(4-methylphenyl)sulfonylacetamide Traditional Name: N-[4-[4-(3-bromobenzoyl)piperazino]phenyl]-2-tosyl-acetamide Formula: C26H26BrN3O4S MolecularWeight: 556.47134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C26H26BrN3O4S/c1-19-5-11-24(12-6-19)35(33,34)18-25(31)28-22-7-9-23(10-8-22)29-13-15-30(16-14-29)26(32)20-3-2-4-21(27)17-20/h2-12,17H,13-16,18H2,1H3,(H,28,31)