3-(4-aminophenyl)-N-(3-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-(4-aminophenyl)-N-(3-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 3-(4-aminophenyl)-N-(3-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-(4-aminophenyl)-N-(3-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: 3-(4-aminophenyl)-N-(3-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [3-(4-aminophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-(3-chlorophenyl)amine Formula: C17H13ClN6 MolecularWeight: 336.77832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=NNC(=C32)C4=CC=C(C=C4)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=NNC(=C32)C4=CC=C(C=C4)N

InChI

InChI=1S/C17H13ClN6/c18-11-2-1-3-13(8-11)22-16-14-15(10-4-6-12(19)7-5-10)23-24-17(14)21-9-20-16/h1-9H,19H2,(H2,20,21,22,23,24)