N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide

Systemtic Name: N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide Openeye Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-6-oxo-1-(p-tolyl)-2-(2-thienyl)piperidine-3-carboxamide CAS Name: N-[4-[(1-methyl-2-imidazolyl)-oxomethyl]phenyl]-1-(4-methylphenyl)-6-oxo-2-thiophen-2-yl-3-piperidinecarboxamide IUPAC Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-1-(4-methylphenyl)-6-oxo-2-thiophen-2-ylpiperidine-3-carboxamide Traditional Name: 6-keto-N-[4-(1-methylimidazole-2-carbonyl)phenyl]-1-(p-tolyl)-2-(2-thienyl)nipecotamide Formula: C28H26N4O3S MolecularWeight: 498.59604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=CC=C(C=C3)C(=O)C4=NC=CN4C)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=CC=C(C=C3)C(=O)C4=NC=CN4C)C5=CC=CS5

InChI

InChI=1S/C28H26N4O3S/c1-18-5-11-21(12-6-18)32-24(33)14-13-22(25(32)23-4-3-17-36-23)28(35)30-20-9-7-19(8-10-20)26(34)27-29-15-16-31(27)2/h3-12,15-17,22,25H,13-14H2,1-2H3,(H,30,35)