8-methyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 8-methyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 8-methyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 8-methyl-2-[[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 8-methyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 8-methyl-2-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]-1H-quinazolin-4-one Formula: C16H14N6OS MolecularWeight: 338.38696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NC=NC4=C3C=NN4C

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C16H14N6OS/c1-9-4-3-5-10-13(9)20-12(21-15(10)23)7-24-16-11-6-19-22(2)14(11)17-8-18-16/h3-6,8H,7H2,1-2H3,(H,20,21,23)