4-(4-chlorophenyl)-N6-cyclopropyl-2-(3-methylphenyl)pyrazolo[3,4-d]pyrimidine-3,6-diamine

Systemtic Name: 4-(4-chlorophenyl)-N6-cyclopropyl-2-(3-methylphenyl)pyrazolo[3,4-d]pyrimidine-3,6-diamine Openeye Name: 4-(4-chlorophenyl)-N6-cyclopropyl-2-(m-tolyl)pyrazolo[3,4-d]pyrimidine-3,6-diamine CAS Name: 4-(4-chlorophenyl)-N6-cyclopropyl-2-(3-methylphenyl)pyrazolo[3,4-d]pyrimidine-3,6-diamine IUPAC Name: 4-(4-chlorophenyl)-6-N-cyclopropyl-2-(3-methylphenyl)pyrazolo[3,4-d]pyrimidine-3,6-diamine Traditional Name: [3-amino-4-(4-chlorophenyl)-2-(m-tolyl)pyrazolo[3,4-d]pyrimidin-6-yl]-cyclopropyl-amine Formula: C21H19ClN6 MolecularWeight: 390.86876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C3C(=NC(=NC3=N2)NC4CC4)C5=CC=C(C=C5)Cl)N

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C3C(=NC(=NC3=N2)NC4CC4)C5=CC=C(C=C5)Cl)N

InChI

InChI=1S/C21H19ClN6/c1-12-3-2-4-16(11-12)28-19(23)17-18(13-5-7-14(22)8-6-13)25-21(24-15-9-10-15)26-20(17)27-28/h2-8,11,15H,9-10,23H2,1H3,(H,24,26,27)