N-[(3,5-dimethoxyphenyl)methyl]-2-[2-(phenylsulfonyl)ethylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-2-[2-(phenylsulfonyl)ethylsulfanyl]pyridine-3-carboxamide Openeye Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-[(3,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-N-[(3,5-dimethoxyphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-[(3,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-(2-besylethylthio)-N-(3,5-dimethoxybenzyl)nicotinamide Formula: C23H24N2O5S2 MolecularWeight: 472.57706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC(=O)C2=C(N=CC=C2)SCCS(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC(=O)C2=C(N=CC=C2)SCCS(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C23H24N2O5S2/c1-29-18-13-17(14-19(15-18)30-2)16-25-22(26)21-9-6-10-24-23(21)31-11-12-32(27,28)20-7-4-3-5-8-20/h3-10,13-15H,11-12,16H2,1-2H3,(H,25,26)