N-pyridin-4-yl-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-pyridin-4-yl-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(4-pyridyl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-pyridin-4-yl-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-pyridin-4-yl-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(4-pyridyl)-2-(4-pyridylmethylthio)nicotinamide Formula: C17H14N4OS MolecularWeight: 322.38426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=CC=NC=C2)C(=O)NC3=CC=NC=C3

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=CC=NC=C2)C(=O)NC3=CC=NC=C3

InChI

InChI=1S/C17H14N4OS/c22-16(21-14-5-10-19-11-6-14)15-2-1-7-20-17(15)23-12-13-3-8-18-9-4-13/h1-11H,12H2,(H,19,21,22)