1-(4-methylphenyl)-6-oxidanylidene-N-(pyridin-3-ylmethyl)-2-thiophen-2-yl-piperidine-3-carboxamide

Systemtic Name: 1-(4-methylphenyl)-6-oxidanylidene-N-(pyridin-3-ylmethyl)-2-thiophen-2-yl-piperidine-3-carboxamide Openeye Name: 6-oxo-1-(p-tolyl)-N-(3-pyridylmethyl)-2-(2-thienyl)piperidine-3-carboxamide CAS Name: 1-(4-methylphenyl)-6-oxo-N-(3-pyridinylmethyl)-2-thiophen-2-yl-3-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)-6-oxo-N-(pyridin-3-ylmethyl)-2-thiophen-2-ylpiperidine-3-carboxamide Traditional Name: 6-keto-1-(p-tolyl)-N-(3-pyridylmethyl)-2-(2-thienyl)nipecotamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCC3=CN=CC=C3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCC3=CN=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H23N3O2S/c1-16-6-8-18(9-7-16)26-21(27)11-10-19(22(26)20-5-3-13-29-20)23(28)25-15-17-4-2-12-24-14-17/h2-9,12-14,19,22H,10-11,15H2,1H3,(H,25,28)