2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(1,2,4-triazol-4-yl)ethanamide

Systemtic Name: 2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(1,2,4-triazol-4-yl)ethanamide Openeye Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(1,2,4-triazol-4-yl)acetamide CAS Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]-N-(1,2,4-triazol-4-yl)acetamide IUPAC Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(1,2,4-triazol-4-yl)acetamide Traditional Name: 2-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]-N-(1,2,4-triazol-4-yl)acetamide Formula: C14H12N6O2S MolecularWeight: 328.34908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)SCC(=O)NN3C=NN=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)SCC(=O)NN3C=NN=C3

InChI

InChI=1S/C14H12N6O2S/c21-12-6-11(10-4-2-1-3-5-10)17-14(18-12)23-7-13(22)19-20-8-15-16-9-20/h1-6,8-9H,7H2,(H,19,22)(H,17,18,21)