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

Systemtic Name: N-butan-2-yl-3-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: 3-(4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-sec-butyl-propanamide CAS Name: N-butan-2-yl-3-(4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-butan-2-yl-3-(4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: 3-(4-keto-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-sec-butyl-propionamide Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CCN1C=NC2=C(C1=O)C=NN2C3=CC=CC=C3

Isomeric SMILES

CCC(C)NC(=O)CCN1C=NC2=C(C1=O)C=NN2C3=CC=CC=C3

InChI

InChI=1S/C18H21N5O2/c1-3-13(2)21-16(24)9-10-22-12-19-17-15(18(22)25)11-20-23(17)14-7-5-4-6-8-14/h4-8,11-13H,3,9-10H2,1-2H3,(H,21,24)