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

Systemtic Name: methyl 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]butanoate Openeye Name: methyl 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]butanoate CAS Name: 4-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]butanoate Traditional Name: 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]butyric acid methyl ester Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC1=NC=NC2=C1C=NN2C3=CC=CC=C3

Isomeric SMILES

COC(=O)CCCNC1=NC=NC2=C1C=NN2C3=CC=CC=C3

InChI

InChI=1S/C16H17N5O2/c1-23-14(22)8-5-9-17-15-13-10-20-21(16(13)19-11-18-15)12-6-3-2-4-7-12/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,17,18,19)