2-methyl-7-methylsulfanyl-8-(phenylsulfonyl)-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one

Systemtic Name: 2-methyl-7-methylsulfanyl-8-(phenylsulfonyl)-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one Openeye Name: 8-(benzenesulfonyl)-2-methyl-7-methylsulfanyl-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one CAS Name: 8-(benzenesulfonyl)-2-methyl-7-(methylthio)-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one IUPAC Name: 8-(benzenesulfonyl)-2-methyl-7-methylsulfanyl-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one Traditional Name: 8-besyl-2-methyl-7-(methylthio)-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one Formula: C13H12N4O3S2 MolecularWeight: 336.38938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)N2C(=N1)C(=C(N2)SC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=O)N2C(=N1)C(=C(N2)SC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C13H12N4O3S2/c1-8-14-11-10(12(21-2)16-17(11)13(18)15-8)22(19,20)9-6-4-3-5-7-9/h3-7,16H,1-2H3