2-methylsulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[(3,4,5-trimethoxyphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-(methylthio)-N-(3,4,5-trimethoxybenzyl)nicotinamide Formula: C17H20N2O4S MolecularWeight: 348.4167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=C(N=CC=C2)SC

InChI

InChI=1S/C17H20N2O4S/c1-21-13-8-11(9-14(22-2)15(13)23-3)10-19-16(20)12-6-5-7-18-17(12)24-4/h5-9H,10H2,1-4H3,(H,19,20)