4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-3-methyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-amine

Systemtic Name: 4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-3-methyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: 4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-3-methyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: 4-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-3-methyl-1-(4-methylphenyl)-6-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 4-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-3-methyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: [4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-3-methyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C23H20ClN7 MolecularWeight: 429.9048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=NC(=NC(=C3C(=N2)C)C4=C(N(N=C4C)C5=CC=CC=C5)Cl)N

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=NC(=NC(=C3C(=N2)C)C4=C(N(N=C4C)C5=CC=CC=C5)Cl)N

InChI

InChI=1S/C23H20ClN7/c1-13-9-11-17(12-10-13)31-22-19(15(3)29-31)20(26-23(25)27-22)18-14(2)28-30(21(18)24)16-7-5-4-6-8-16/h4-12H,1-3H3,(H2,25,26,27)