N-(3-methoxyphenyl)-3-[1-(2-methylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]propanamide

Systemtic Name: N-(3-methoxyphenyl)-3-[1-(2-methylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]propanamide Openeye Name: N-(3-methoxyphenyl)-3-[1-(2-methylsulfanylpyridine-3-carbonyl)-4-piperidyl]propanamide CAS Name: N-(3-methoxyphenyl)-3-[1-[[2-(methylthio)-3-pyridinyl]-oxomethyl]-4-piperidinyl]propanamide IUPAC Name: N-(3-methoxyphenyl)-3-[1-(2-methylsulfanylpyridine-3-carbonyl)piperidin-4-yl]propanamide Traditional Name: N-(3-methoxyphenyl)-3-[1-[2-(methylthio)nicotinoyl]-4-piperidyl]propionamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CCC2CCN(CC2)C(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CCC2CCN(CC2)C(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C22H27N3O3S/c1-28-18-6-3-5-17(15-18)24-20(26)9-8-16-10-13-25(14-11-16)22(27)19-7-4-12-23-21(19)29-2/h3-7,12,15-16H,8-11,13-14H2,1-2H3,(H,24,26)