5-methylsulfanyl-2-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 5-methylsulfanyl-2-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 5-methylsulfanyl-2-phenyl-3H-triazolo[4,5-d]pyrimidin-7-one CAS Name: 5-(methylthio)-2-phenyl-3H-triazolo[4,5-d]pyrimidin-7-one IUPAC Name: 5-methylsulfanyl-2-phenyl-3H-triazolo[4,5-d]pyrimidin-7-one Traditional Name: 5-(methylthio)-2-phenyl-3H-triazolo[4,5-d]pyrimidin-7-one Formula: C11H9N5OS MolecularWeight: 259.28706

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)C2=NN(NC2=N1)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=O)C2=NN(NC2=N1)C3=CC=CC=C3

InChI

InChI=1S/C11H9N5OS/c1-18-11-12-9-8(10(17)13-11)14-16(15-9)7-5-3-2-4-6-7/h2-6H,1H3,(H,12,13,15,17)