N-(furan-2-ylmethyl)-N,6-dimethyl-2-[1-[2-(2-phenylethenylsulfanyl)ethanoyl]piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-N,6-dimethyl-2-[1-[2-(2-phenylethenylsulfanyl)ethanoyl]piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-(2-furylmethyl)-N,6-dimethyl-2-[1-(2-styrylsulfanylacetyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: N-(2-furanylmethyl)-N,6-dimethyl-2-[1-[1-oxo-2-(2-phenylethenylthio)ethyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-N,6-dimethyl-2-[1-[2-(2-phenylethenylsulfanyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-(2-furfuryl)-N,6-dimethyl-2-[1-[2-(styrylthio)acetyl]-4-piperidyl]nicotinamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)N(C)CC2=CC=CO2)C3CCN(CC3)C(=O)CSC=CC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)N(C)CC2=CC=CO2)C3CCN(CC3)C(=O)CSC=CC4=CC=CC=C4

InChI

InChI=1S/C28H31N3O3S/c1-21-10-11-25(28(33)30(2)19-24-9-6-17-34-24)27(29-21)23-12-15-31(16-13-23)26(32)20-35-18-14-22-7-4-3-5-8-22/h3-11,14,17-18,23H,12-13,15-16,19-20H2,1-2H3