N-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-(4-phenylpiperazin-1-yl)sulfonyl-N-propyl-benzamide

Systemtic Name: N-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-(4-phenylpiperazin-1-yl)sulfonyl-N-propyl-benzamide Openeye Name: N-[2-(2-methylanilino)-2-oxo-ethyl]-3-(4-phenylpiperazin-1-yl)sulfonyl-N-propyl-benzamide CAS Name: N-[2-(2-methylanilino)-2-oxoethyl]-3-[(4-phenyl-1-piperazinyl)sulfonyl]-N-propylbenzamide IUPAC Name: N-[2-(2-methylanilino)-2-oxoethyl]-3-(4-phenylpiperazin-1-yl)sulfonyl-N-propylbenzamide Traditional Name: N-[2-keto-2-(o-toluidino)ethyl]-3-(4-phenylpiperazino)sulfonyl-N-propyl-benzamide Formula: C29H34N4O4S MolecularWeight: 534.66966

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C29H34N4O4S/c1-3-16-32(22-28(34)30-27-15-8-7-10-23(27)2)29(35)24-11-9-14-26(21-24)38(36,37)33-19-17-31(18-20-33)25-12-5-4-6-13-25/h4-15,21H,3,16-20,22H2,1-2H3,(H,30,34)