N4-[6-cyclopropyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]cyclohexane-1,4-diamine

Systemtic Name: N4-[6-cyclopropyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]cyclohexane-1,4-diamine Openeye Name: N4-[6-cyclopropyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]cyclohexane-1,4-diamine CAS Name: N4-[6-cyclopropyl-1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-[6-cyclopropyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-[6-cyclopropyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C21H26N6 MolecularWeight: 362.47134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)C4CC4)NC5CCC(CC5)N

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)C4CC4)NC5CCC(CC5)N

InChI

InChI=1S/C21H26N6/c1-13-2-10-17(11-3-13)27-21-18(12-23-27)20(25-19(26-21)14-4-5-14)24-16-8-6-15(22)7-9-16/h2-3,10-12,14-16H,4-9,22H2,1H3,(H,24,25,26)