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

Systemtic Name: N-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-N-propyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[2-(2-methylanilino)-2-oxo-ethyl]-N-propyl-benzamide CAS Name: N-[2-(2-methylanilino)-2-oxoethyl]-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-N-propylbenzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylbenzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-[2-keto-2-(o-toluidino)ethyl]-N-propyl-benzamide Formula: C30H36N4O4S MolecularWeight: 548.69624

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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)CC4=CC=CC=C4

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C30H36N4O4S/c1-3-16-33(23-29(35)31-28-15-8-7-10-24(28)2)30(36)26-13-9-14-27(21-26)39(37,38)34-19-17-32(18-20-34)22-25-11-5-4-6-12-25/h4-15,21H,3,16-20,22-23H2,1-2H3,(H,31,35)