N-[(2,4-dimethoxyphenyl)methyl]-3-[1-(2-methylsulfanylethanoyl)piperidin-3-yl]propanamide

Systemtic Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[1-(2-methylsulfanylethanoyl)piperidin-3-yl]propanamide Openeye Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[1-(2-methylsulfanylacetyl)-3-piperidyl]propanamide CAS Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[1-[2-(methylthio)-1-oxoethyl]-3-piperidinyl]propanamide IUPAC Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[1-(2-methylsulfanylacetyl)piperidin-3-yl]propanamide Traditional Name: N-(2,4-dimethoxybenzyl)-3-[1-[2-(methylthio)acetyl]-3-piperidyl]propionamide Formula: C20H30N2O4S MolecularWeight: 394.5282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(=O)CCC2CCCN(C2)C(=O)CSC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC(=O)CCC2CCCN(C2)C(=O)CSC)OC

InChI

InChI=1S/C20H30N2O4S/c1-25-17-8-7-16(18(11-17)26-2)12-21-19(23)9-6-15-5-4-10-22(13-15)20(24)14-27-3/h7-8,11,15H,4-6,9-10,12-14H2,1-3H3,(H,21,23)