5-cyano-2-pyridin-3-yl-4-pyridin-4-yl-6-sulfanyl-1,4-dihydropyridine-3-carbothioamide

Systemtic Name: 5-cyano-2-pyridin-3-yl-4-pyridin-4-yl-6-sulfanyl-1,4-dihydropyridine-3-carbothioamide Openeye Name: 5-cyano-2-(3-pyridyl)-4-(4-pyridyl)-6-sulfanyl-1,4-dihydropyridine-3-carbothioamide CAS Name: 5-cyano-6-mercapto-2-(3-pyridinyl)-4-pyridin-4-yl-1,4-dihydropyridine-3-carbothioamide IUPAC Name: 5-cyano-2-pyridin-3-yl-4-pyridin-4-yl-6-sulfanyl-1,4-dihydropyridine-3-carbothioamide Traditional Name: 5-cyano-6-mercapto-2-(3-pyridyl)-4-(4-pyridyl)-1,4-dihydropyridine-3-carbothioamide Formula: C17H13N5S2 MolecularWeight: 351.44862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=C(C(C(=C(N2)S)C#N)C3=CC=NC=C3)C(=S)N

Isomeric SMILES

C1=CC(=CN=C1)C2=C(C(C(=C(N2)S)C#N)C3=CC=NC=C3)C(=S)N

InChI

InChI=1S/C17H13N5S2/c18-8-12-13(10-3-6-20-7-4-10)14(16(19)23)15(22-17(12)24)11-2-1-5-21-9-11/h1-7,9,13,22,24H,(H2,19,23)