3-[(6-azanyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-4-methyl-N-(1H-pyrazol-5-yl)benzamide

Systemtic Name: 3-[(6-azanyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-4-methyl-N-(1H-pyrazol-5-yl)benzamide Openeye Name: 3-[(6-amino-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-4-methyl-N-(1H-pyrazol-5-yl)benzamide CAS Name: 3-[(6-amino-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]-4-methyl-N-(1H-pyrazol-5-yl)benzamide IUPAC Name: 3-[(6-amino-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-4-methyl-N-(1H-pyrazol-5-yl)benzamide Traditional Name: 3-[(6-amino-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-4-methyl-N-(1H-pyrazol-5-yl)benzamide Formula: C22H19N9O MolecularWeight: 425.44596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=NN2)NC3=NC(=NC4=C3C=NN4C5=CC=CC=C5)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=NN2)NC3=NC(=NC4=C3C=NN4C5=CC=CC=C5)N

InChI

InChI=1S/C22H19N9O/c1-13-7-8-14(21(32)27-18-9-10-24-30-18)11-17(13)26-19-16-12-25-31(15-5-3-2-4-6-15)20(16)29-22(23)28-19/h2-12H,1H3,(H3,23,26,28,29)(H2,24,27,30,32)