1-phenyl-2-([1,2,4]triazolo[4,3-a]pyrimidin-3-ylsulfanyl)ethanone

Systemtic Name: 1-phenyl-2-([1,2,4]triazolo[4,3-a]pyrimidin-3-ylsulfanyl)ethanone Openeye Name: 1-phenyl-2-([1,2,4]triazolo[4,3-a]pyrimidin-3-ylsulfanyl)ethanone CAS Name: 1-phenyl-2-([1,2,4]triazolo[4,3-a]pyrimidin-3-ylthio)ethanone IUPAC Name: 1-phenyl-2-([1,2,4]triazolo[4,3-a]pyrimidin-3-ylsulfanyl)ethanone Traditional Name: 1-phenyl-2-([1,2,4]triazolo[4,3-a]pyrimidin-3-ylthio)ethanone Formula: C13H10N4OS MolecularWeight: 270.3097

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NN=C3N2C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NN=C3N2C=CC=N3

InChI

InChI=1S/C13H10N4OS/c18-11(10-5-2-1-3-6-10)9-19-13-16-15-12-14-7-4-8-17(12)13/h1-8H,9H2