N-(2-chloranyl-5-methyl-phenyl)-2-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)-3-oxidanylidene-butanamide

Systemtic Name: N-(2-chloranyl-5-methyl-phenyl)-2-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)-3-oxidanylidene-butanamide Openeye Name: N-(2-chloro-5-methyl-phenyl)-2-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)-3-oxo-butanamide CAS Name: N-(2-chloro-5-methylphenyl)-2-(4-methyl-1-pyrazolo[3,4-d]pyrimidinyl)-3-oxobutanamide IUPAC Name: N-(2-chloro-5-methylphenyl)-2-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)-3-oxobutanamide Traditional Name: N-(2-chloro-5-methyl-phenyl)-3-keto-2-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)butyramide Formula: C17H16ClN5O2 MolecularWeight: 357.79424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C)N2C3=NC=NC(=C3C=N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C)N2C3=NC=NC(=C3C=N2)C

InChI

InChI=1S/C17H16ClN5O2/c1-9-4-5-13(18)14(6-9)22-17(25)15(11(3)24)23-16-12(7-21-23)10(2)19-8-20-16/h4-8,15H,1-3H3,(H,22,25)