1-[1-(4-methylphenyl)-5-oxidanylidene-2-thiophen-2-yl-pyrrolidin-3-yl]carbonyl-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[1-(4-methylphenyl)-5-oxidanylidene-2-thiophen-2-yl-pyrrolidin-3-yl]carbonyl-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[5-oxo-1-(p-tolyl)-2-(2-thienyl)pyrrolidine-3-carbonyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[[1-(4-methylphenyl)-5-oxo-2-thiophen-2-yl-3-pyrrolidinyl]-oxomethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[1-(4-methylphenyl)-5-oxo-2-thiophen-2-ylpyrrolidine-3-carbonyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[5-keto-1-(p-tolyl)-2-(2-thienyl)pyrrolidine-3-carbonyl]-N-phenyl-isonipecotamide Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CC2=O)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CC2=O)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C28H29N3O3S/c1-19-9-11-22(12-10-19)31-25(32)18-23(26(31)24-8-5-17-35-24)28(34)30-15-13-20(14-16-30)27(33)29-21-6-3-2-4-7-21/h2-12,17,20,23,26H,13-16,18H2,1H3,(H,29,33)