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

Systemtic Name: 1-methyl-4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine Openeye Name: 1-methyl-4-[4-(p-tolylmethyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidine CAS Name: 1-methyl-4-[4-[(4-methylphenyl)methyl]-1-piperazinyl]pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-methyl-4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine Traditional Name: 1-methyl-4-[4-(4-methylbenzyl)piperazino]pyrazolo[3,4-d]pyrimidine Formula: C18H22N6 MolecularWeight: 322.40748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC=NC4=C3C=NN4C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C18H22N6/c1-14-3-5-15(6-4-14)12-23-7-9-24(10-8-23)18-16-11-21-22(2)17(16)19-13-20-18/h3-6,11,13H,7-10,12H2,1-2H3