N-(4-methyl-3-oxidanyl-phenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(4-methyl-3-oxidanyl-phenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(3-hydroxy-4-methyl-phenyl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(3-hydroxy-4-methylphenyl)-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(3-hydroxy-4-methylphenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(3-hydroxy-4-methyl-phenyl)-2-(4-pyridylmethylthio)nicotinamide Formula: C19H17N3O2S MolecularWeight: 351.42218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC=C3)O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC=C3)O

InChI

InChI=1S/C19H17N3O2S/c1-13-4-5-15(11-17(13)23)22-18(24)16-3-2-8-21-19(16)25-12-14-6-9-20-10-7-14/h2-11,23H,12H2,1H3,(H,22,24)