N-(2-ethyl-6-methyl-phenyl)-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-(2-ethyl-6-methylphenyl)-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CCN2C=NC3=C(C2=O)C=NN3C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CCN2C=NC3=C(C2=O)C=NN3C)C

InChI

InChI=1S/C18H21N5O2/c1-4-13-7-5-6-12(2)16(13)21-15(24)8-9-23-11-19-17-14(18(23)25)10-20-22(17)3/h5-7,10-11H,4,8-9H2,1-3H3,(H,21,24)