ethyl 2-[[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanoate

Systemtic Name: ethyl 2-[[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanoate Openeye Name: ethyl 2-[[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]acetate CAS Name: 2-[[1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]acetate Traditional Name: 2-[[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]acetic acid ethyl ester Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=NC=NC2=C1C=NN2C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)CNC1=NC=NC2=C1C=NN2C3=CC=C(C=C3)C

InChI

InChI=1S/C16H17N5O2/c1-3-23-14(22)9-17-15-13-8-20-21(16(13)19-10-18-15)12-6-4-11(2)5-7-12/h4-8,10H,3,9H2,1-2H3,(H,17,18,19)