N-[2,6-bis(oxidanylidene)-3-phenyl-pyrimidin-4-yl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-[2,6-bis(oxidanylidene)-3-phenyl-pyrimidin-4-yl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(2,6-dioxo-3-phenyl-pyrimidin-4-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(2,6-dioxo-3-phenyl-4-pyrimidinyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(2,6-dioxo-3-phenylpyrimidin-4-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(2,6-diketo-3-phenyl-pyrimidin-4-yl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C14H12N6O3S MolecularWeight: 344.34848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC(=O)NC2=O)NC(=O)CSC3=NC=NN3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC(=O)NC2=O)NC(=O)CSC3=NC=NN3

InChI

InChI=1S/C14H12N6O3S/c21-11-6-10(17-12(22)7-24-13-15-8-16-19-13)20(14(23)18-11)9-4-2-1-3-5-9/h1-6,8H,7H2,(H,17,22)(H,15,16,19)(H,18,21,23)