[(3R)-1-(2,6-dimethoxypyridin-3-yl)carbonylpiperidin-3-yl]-(4-methylsulfanylphenyl)methanone

Systemtic Name: [(3R)-1-(2,6-dimethoxypyridin-3-yl)carbonylpiperidin-3-yl]-(4-methylsulfanylphenyl)methanone Openeye Name: [(3R)-1-(2,6-dimethoxypyridine-3-carbonyl)-3-piperidyl]-(4-methylsulfanylphenyl)methanone CAS Name: [(3R)-1-[(2,6-dimethoxy-3-pyridinyl)-oxomethyl]-3-piperidinyl]-[4-(methylthio)phenyl]methanone IUPAC Name: [(3R)-1-(2,6-dimethoxypyridine-3-carbonyl)piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Traditional Name: [(3R)-1-(2,6-dimethoxynicotinoyl)-3-piperidyl]-[4-(methylthio)phenyl]methanone Formula: C21H24N2O4S MolecularWeight: 400.49126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1)C(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)SC)OC

Isomeric SMILES

COC1=NC(=C(C=C1)C(=O)N2CCC[C@H](C2)C(=O)C3=CC=C(C=C3)SC)OC

InChI

InChI=1S/C21H24N2O4S/c1-26-18-11-10-17(20(22-18)27-2)21(25)23-12-4-5-15(13-23)19(24)14-6-8-16(28-3)9-7-14/h6-11,15H,4-5,12-13H2,1-3H3/t15-/m1/s1