2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[(2S)-2-phenylpropyl]ethanamide

Systemtic Name: 2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[(2S)-2-phenylpropyl]ethanamide Openeye Name: 2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[(2S)-2-phenylpropyl]acetamide CAS Name: 2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-[(2S)-2-phenylpropyl]acetamide IUPAC Name: 2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-[(2S)-2-phenylpropyl]acetamide Traditional Name: 2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[(2S)-2-phenylpropyl]acetamide Formula: C17H19N5O2 MolecularWeight: 325.36506

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CN1C=NC2=C(C1=O)C=NN2C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)CN1C=NC2=C(C1=O)C=NN2C)C3=CC=CC=C3

InChI

InChI=1S/C17H19N5O2/c1-12(13-6-4-3-5-7-13)8-18-15(23)10-22-11-19-16-14(17(22)24)9-20-21(16)2/h3-7,9,11-12H,8,10H2,1-2H3,(H,18,23)/t12-/m1/s1