N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-5-oxo-1-phenethyl-pyrrolidine-3-carboxamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-5-oxo-1-phenethyl-3-pyrrolidinecarboxamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-5-oxo-1-phenethylpyrrolidine-3-carboxamide Traditional Name: 5-keto-N-[3-[4-(m-tolyl)piperazino]propyl]-1-phenethyl-pyrrolidine-3-carboxamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4

InChI

InChI=1S/C27H36N4O2/c1-22-7-5-10-25(19-22)30-17-15-29(16-18-30)13-6-12-28-27(33)24-20-26(32)31(21-24)14-11-23-8-3-2-4-9-23/h2-5,7-10,19,24H,6,11-18,20-21H2,1H3,(H,28,33)