methyl 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzoate

Systemtic Name: methyl 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzoate Openeye Name: methyl 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzoate CAS Name: 4-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzoic acid methyl ester Formula: C19H15N5O2 MolecularWeight: 345.3547

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C19H15N5O2/c1-26-19(25)13-7-9-14(10-8-13)23-17-16-11-22-24(18(16)21-12-20-17)15-5-3-2-4-6-15/h2-12H,1H3,(H,20,21,23)