2-methylsulfanyl-7-phenyl-3-(phenylmethyl)pyrazolo[1,5-a][1,3,5]triazin-4-one

Systemtic Name: 2-methylsulfanyl-7-phenyl-3-(phenylmethyl)pyrazolo[1,5-a][1,3,5]triazin-4-one Openeye Name: 3-benzyl-2-methylsulfanyl-7-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-one CAS Name: 2-(methylthio)-7-phenyl-3-(phenylmethyl)-4-pyrazolo[1,5-a][1,3,5]triazinone IUPAC Name: 3-benzyl-2-methylsulfanyl-7-phenylpyrazolo[1,5-a][1,3,5]triazin-4-one Traditional Name: 3-benzyl-2-(methylthio)-7-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-one Formula: C19H16N4OS MolecularWeight: 348.42154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=CC(=NN2C(=O)N1CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CSC1=NC2=CC(=NN2C(=O)N1CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4OS/c1-25-18-20-17-12-16(15-10-6-3-7-11-15)21-23(17)19(24)22(18)13-14-8-4-2-5-9-14/h2-12H,13H2,1H3