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

Systemtic Name: 2-tert-butyl-4-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-3-amine Openeye Name: 2-tert-butyl-4-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-3-amine CAS Name: 2-tert-butyl-4-(4-chlorophenyl)-6-(4-methyl-1-piperazinyl)-3-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 2-tert-butyl-4-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-3-amine Traditional Name: [2-tert-butyl-4-(4-chlorophenyl)-6-(4-methylpiperazino)pyrazolo[3,4-d]pyrimidin-3-yl]amine Formula: C20H26ClN7 MolecularWeight: 399.92034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=C2C(=NC(=NC2=N1)N3CCN(CC3)C)C4=CC=C(C=C4)Cl)N

Isomeric SMILES

CC(C)(C)N1C(=C2C(=NC(=NC2=N1)N3CCN(CC3)C)C4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C20H26ClN7/c1-20(2,3)28-17(22)15-16(13-5-7-14(21)8-6-13)23-19(24-18(15)25-28)27-11-9-26(4)10-12-27/h5-8H,9-12,22H2,1-4H3