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

Systemtic Name: 4-(4-chlorophenyl)-N6-cyclohexyl-2-phenyl-pyrazolo[3,4-d]pyrimidine-3,6-diamine Openeye Name: 4-(4-chlorophenyl)-N6-cyclohexyl-2-phenyl-pyrazolo[3,4-d]pyrimidine-3,6-diamine CAS Name: 4-(4-chlorophenyl)-N6-cyclohexyl-2-phenylpyrazolo[3,4-d]pyrimidine-3,6-diamine IUPAC Name: 4-(4-chlorophenyl)-6-N-cyclohexyl-2-phenylpyrazolo[3,4-d]pyrimidine-3,6-diamine Traditional Name: [3-amino-4-(4-chlorophenyl)-2-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]-cyclohexyl-amine Formula: C23H23ClN6 MolecularWeight: 418.92192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC3=NN(C(=C3C(=N2)C4=CC=C(C=C4)Cl)N)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC2=NC3=NN(C(=C3C(=N2)C4=CC=C(C=C4)Cl)N)C5=CC=CC=C5

InChI

InChI=1S/C23H23ClN6/c24-16-13-11-15(12-14-16)20-19-21(25)30(18-9-5-2-6-10-18)29-22(19)28-23(27-20)26-17-7-3-1-4-8-17/h2,5-6,9-14,17H,1,3-4,7-8,25H2,(H,26,28,29)