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

Systemtic Name: 2-(4-chlorophenyl)-N6-cyclopropyl-4-phenyl-pyrazolo[3,4-d]pyrimidine-3,6-diamine Openeye Name: 2-(4-chlorophenyl)-N6-cyclopropyl-4-phenyl-pyrazolo[3,4-d]pyrimidine-3,6-diamine CAS Name: 2-(4-chlorophenyl)-N6-cyclopropyl-4-phenylpyrazolo[3,4-d]pyrimidine-3,6-diamine IUPAC Name: 2-(4-chlorophenyl)-6-N-cyclopropyl-4-phenylpyrazolo[3,4-d]pyrimidine-3,6-diamine Traditional Name: [3-amino-2-(4-chlorophenyl)-4-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]-cyclopropyl-amine Formula: C20H17ClN6 MolecularWeight: 376.84218

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC3=NN(C(=C3C(=N2)C4=CC=CC=C4)N)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CC1NC2=NC3=NN(C(=C3C(=N2)C4=CC=CC=C4)N)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C20H17ClN6/c21-13-6-10-15(11-7-13)27-18(22)16-17(12-4-2-1-3-5-12)24-20(23-14-8-9-14)25-19(16)26-27/h1-7,10-11,14H,8-9,22H2,(H,23,25,26)