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

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C17H18ClN5O3 MolecularWeight: 375.80952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C17H18ClN5O3/c1-10-6-13(14(26-3)7-12(10)18)21-15(24)4-5-23-9-19-16-11(17(23)25)8-20-22(16)2/h6-9H,4-5H2,1-3H3,(H,21,24)