N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-methylcyclohexa-2,5-dien-1-yl)carbonylpiperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-methylcyclohexa-2,5-dien-1-yl)carbonylpiperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-methylcyclohexa-2,5-diene-1-carbonyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-6-methyl-2-[1-[(2-methyl-1-cyclohexa-2,5-dienyl)-oxomethyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-methylcyclohexa-2,5-diene-1-carbonyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-6-methyl-2-[1-(2-methylcyclohexa-2,5-diene-1-carbonyl)-4-piperidyl]nicotinamide Formula: C27H33N3O3S MolecularWeight: 479.63422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC=CC1C(=O)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NCCSCC4=CC=CO4

Isomeric SMILES

CC1=CCC=CC1C(=O)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NCCSCC4=CC=CO4

InChI

InChI=1S/C27H33N3O3S/c1-19-6-3-4-8-23(19)27(32)30-14-11-21(12-15-30)25-24(10-9-20(2)29-25)26(31)28-13-17-34-18-22-7-5-16-33-22/h4-10,16,21,23H,3,11-15,17-18H2,1-2H3,(H,28,31)