methyl 2-[4-[(4-methoxyphenyl)carbonylamino]pyrazolo[3,4-d]pyrimidin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[(4-methoxyphenyl)carbonylamino]pyrazolo[3,4-d]pyrimidin-1-yl]ethanoate Openeye Name: methyl 2-[4-[(4-methoxybenzoyl)amino]pyrazolo[3,4-d]pyrimidin-1-yl]acetate CAS Name: 2-[4-[[(4-methoxyphenyl)-oxomethyl]amino]-1-pyrazolo[3,4-d]pyrimidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(4-methoxybenzoyl)amino]pyrazolo[3,4-d]pyrimidin-1-yl]acetate Traditional Name: 2-[4-(p-anisoylamino)pyrazolo[3,4-d]pyrimidin-1-yl]acetic acid methyl ester Formula: C16H15N5O4 MolecularWeight: 341.3214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=NC=NC3=C2C=NN3CC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=NC=NC3=C2C=NN3CC(=O)OC

InChI

InChI=1S/C16H15N5O4/c1-24-11-5-3-10(4-6-11)16(23)20-14-12-7-19-21(8-13(22)25-2)15(12)18-9-17-14/h3-7,9H,8H2,1-2H3,(H,17,18,20,23)