N-(3-ethanoylphenyl)-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(3-ethanoylphenyl)-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(3-acetylphenyl)-3-(4-benzylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(3-acetylphenyl)-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(3-acetylphenyl)-3-(4-benzylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(3-acetylphenyl)-3-(4-benzylpiperazino)sulfonyl-benzamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4S/c1-20(30)22-9-5-11-24(17-22)27-26(31)23-10-6-12-25(18-23)34(32,33)29-15-13-28(14-16-29)19-21-7-3-2-4-8-21/h2-12,17-18H,13-16,19H2,1H3,(H,27,31)