N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]benzamide CAS Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]benzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-benzamide Formula: C28H32N4O4S MolecularWeight: 520.64308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C28H32N4O4S/c1-22-11-13-25(14-12-22)29-27(33)21-30(2)28(34)24-9-6-10-26(19-24)37(35,36)32-17-15-31(16-18-32)20-23-7-4-3-5-8-23/h3-14,19H,15-18,20-21H2,1-2H3,(H,29,33)