3-(1-tert-butyl-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(3,5-dimethylphenyl)propanamide

Systemtic Name: 3-(1-tert-butyl-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(3,5-dimethylphenyl)propanamide Openeye Name: 3-(1-tert-butyl-6-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(3,5-dimethylphenyl)propanamide CAS Name: 3-(1-tert-butyl-6-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(3,5-dimethylphenyl)propanamide IUPAC Name: 3-(1-tert-butyl-6-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(3,5-dimethylphenyl)propanamide Traditional Name: 3-(1-tert-butyl-4-keto-6-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(3,5-dimethylphenyl)propionamide Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CCN2C(=NC3=C(C2=O)C=NN3C(C)(C)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CCN2C(=NC3=C(C2=O)C=NN3C(C)(C)C)C)C

InChI

InChI=1S/C21H27N5O2/c1-13-9-14(2)11-16(10-13)24-18(27)7-8-25-15(3)23-19-17(20(25)28)12-22-26(19)21(4,5)6/h9-12H,7-8H2,1-6H3,(H,24,27)