1-tert-butyl-3,6-bis(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-tert-butyl-3,6-bis(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-tert-butyl-3,6-bis(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-tert-butyl-3,6-bis(4-chlorophenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-tert-butyl-3,6-bis(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-tert-butyl-3,6-bis(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C21H19Cl2N5 MolecularWeight: 412.31506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C(=N1)C3=CC=C(C=C3)Cl)C(=NC(=N2)C4=CC=C(C=C4)Cl)N

Isomeric SMILES

CC(C)(C)N1C2=C(C(=N1)C3=CC=C(C=C3)Cl)C(=NC(=N2)C4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C21H19Cl2N5/c1-21(2,3)28-20-16(17(27-28)12-4-8-14(22)9-5-12)18(24)25-19(26-20)13-6-10-15(23)11-7-13/h4-11H,1-3H3,(H2,24,25,26)