N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-[(2-oxidanylidene-1H-quinolin-4-yl)carbonyl]piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-[(2-oxidanylidene-1H-quinolin-4-yl)carbonyl]piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-oxo-1H-quinoline-4-carbonyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-6-methyl-2-[1-[oxo-(2-oxo-1H-quinolin-4-yl)methyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-oxo-1H-quinoline-4-carbonyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-2-[1-(2-keto-1H-quinoline-4-carbonyl)-4-piperidyl]-6-methyl-nicotinamide Formula: C29H30N4O4S MolecularWeight: 530.6379

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCSCC2=CC=CO2)C3CCN(CC3)C(=O)C4=CC(=O)NC5=CC=CC=C54

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCSCC2=CC=CO2)C3CCN(CC3)C(=O)C4=CC(=O)NC5=CC=CC=C54

InChI

InChI=1S/C29H30N4O4S/c1-19-8-9-23(28(35)30-12-16-38-18-21-5-4-15-37-21)27(31-19)20-10-13-33(14-11-20)29(36)24-17-26(34)32-25-7-3-2-6-22(24)25/h2-9,15,17,20H,10-14,16,18H2,1H3,(H,30,35)(H,32,34)