N-(2-methylphenyl)-1-[4-(4-methylpiperazin-1-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(2-methylphenyl)-1-[4-(4-methylpiperazin-1-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-[4-(4-methylpiperazin-1-yl)phenyl]-N-(o-tolyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(2-methylphenyl)-1-[4-(4-methyl-1-piperazinyl)phenyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(2-methylphenyl)-1-[4-(4-methylpiperazin-1-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-[4-(4-methylpiperazino)phenyl]pyrazolo[3,4-d]pyrimidin-4-yl]-(o-tolyl)amine Formula: C23H25N7 MolecularWeight: 399.4915

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=CC=CC=C1NC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C23H25N7/c1-17-5-3-4-6-21(17)27-22-20-15-26-30(23(20)25-16-24-22)19-9-7-18(8-10-19)29-13-11-28(2)12-14-29/h3-10,15-16H,11-14H2,1-2H3,(H,24,25,27)