8-(3-chloranyl-4-methylsulfanyl-phenyl)-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one

Systemtic Name: 8-(3-chloranyl-4-methylsulfanyl-phenyl)-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one Openeye Name: 8-(3-chloro-4-methylsulfanyl-phenyl)-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one CAS Name: 8-[3-chloro-4-(methylthio)phenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one IUPAC Name: 8-(3-chloro-4-methylsulfanylphenyl)-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one Traditional Name: 8-[3-chloro-4-(methylthio)phenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one Formula: C12H9ClN4OS MolecularWeight: 292.74406

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C2=CNN3C2=NC=NC3=O)Cl

Isomeric SMILES

CSC1=C(C=C(C=C1)C2=CNN3C2=NC=NC3=O)Cl

InChI

InChI=1S/C12H9ClN4OS/c1-19-10-3-2-7(4-9(10)13)8-5-16-17-11(8)14-6-15-12(17)18/h2-6,16H,1H3