1-(4-methylphenyl)-5-oxidanylidene-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-methylphenyl)-5-oxidanylidene-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]pyrrolidine-3-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-2-(2-thienyl)ethyl]-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxamide CAS Name: 1-(4-methylphenyl)-5-oxo-N-[1-[4-(phenylmethyl)-1-piperazinyl]-1-thiophen-2-ylpropan-2-yl]-3-pyrrolidinecarboxamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)-1-methyl-2-(2-thienyl)ethyl]-5-keto-1-(p-tolyl)pyrrolidine-3-carboxamide Formula: C30H36N4O2S MolecularWeight: 516.69744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC(C)C(C3=CC=CS3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC(C)C(C3=CC=CS3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H36N4O2S/c1-22-10-12-26(13-11-22)34-21-25(19-28(34)35)30(36)31-23(2)29(27-9-6-18-37-27)33-16-14-32(15-17-33)20-24-7-4-3-5-8-24/h3-13,18,23,25,29H,14-17,19-21H2,1-2H3,(H,31,36)