4-[4-(3-methylphenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[4-(3-methylphenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[4-(m-tolyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(3-methylphenyl)-1-piperazinyl]-1H-pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[4-(3-methylphenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine Traditional Name: 4-[4-(m-tolyl)piperazino]-1H-pyrazolo[3,4-d]pyrimidine Formula: C16H18N6 MolecularWeight: 294.35432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C3=NC=NC4=C3C=NN4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C3=NC=NC4=C3C=NN4

InChI

InChI=1S/C16H18N6/c1-12-3-2-4-13(9-12)21-5-7-22(8-6-21)16-14-10-19-20-15(14)17-11-18-16/h2-4,9-11H,5-8H2,1H3,(H,17,18,19,20)