(4-methoxy-2-methyl-phenyl)-[1-(2-methylsulfanylpyridin-3-yl)carbonylpiperidin-3-yl]methanone

Systemtic Name: (4-methoxy-2-methyl-phenyl)-[1-(2-methylsulfanylpyridin-3-yl)carbonylpiperidin-3-yl]methanone Openeye Name: (4-methoxy-2-methyl-phenyl)-[1-(2-methylsulfanylpyridine-3-carbonyl)-3-piperidyl]methanone CAS Name: (4-methoxy-2-methylphenyl)-[1-[[2-(methylthio)-3-pyridinyl]-oxomethyl]-3-piperidinyl]methanone IUPAC Name: (4-methoxy-2-methylphenyl)-[1-(2-methylsulfanylpyridine-3-carbonyl)piperidin-3-yl]methanone Traditional Name: (4-methoxy-2-methyl-phenyl)-[1-[2-(methylthio)nicotinoyl]-3-piperidyl]methanone Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)C2CCCN(C2)C(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)C2CCCN(C2)C(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C21H24N2O3S/c1-14-12-16(26-2)8-9-17(14)19(24)15-6-5-11-23(13-15)21(25)18-7-4-10-22-20(18)27-3/h4,7-10,12,15H,5-6,11,13H2,1-3H3