1-(4-chlorophenyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-propan-1-one

Systemtic Name: 1-(4-chlorophenyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-propan-1-one Openeye Name: 1-(4-chlorophenyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-propan-1-one CAS Name: 1-(4-chlorophenyl)-2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-1-propanone IUPAC Name: 1-(4-chlorophenyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylpropan-1-one Traditional Name: 1-(4-chlorophenyl)-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]propan-1-one Formula: C15H13ClN4OS MolecularWeight: 332.80792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Cl)SC2=NC=NC3=C2C=NN3C

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Cl)SC2=NC=NC3=C2C=NN3C

InChI

InChI=1S/C15H13ClN4OS/c1-9(13(21)10-3-5-11(16)6-4-10)22-15-12-7-19-20(2)14(12)17-8-18-15/h3-9H,1-2H3