2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyridin-4-yl-ethanamide

Systemtic Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyridin-4-yl-ethanamide Openeye Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-pyridyl)acetamide CAS Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)thio]-N-pyridin-4-ylacetamide IUPAC Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyridin-4-ylacetamide Traditional Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)thio]-N-(4-pyridyl)acetamide Formula: C15H13N5OS MolecularWeight: 311.36162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NC3=CC=NC=C3

InChI

InChI=1S/C15H13N5OS/c21-14(18-12-6-8-16-9-7-12)10-22-15-17-11-20(19-15)13-4-2-1-3-5-13/h1-9,11H,10H2,(H,16,18,21)