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

Systemtic Name: N-[1-(2-methoxy-5-methyl-phenyl)ethyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-[1-(2-methoxy-5-methyl-phenyl)ethyl]-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-[1-(2-methoxy-5-methylphenyl)ethyl]-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-[1-(2-methoxy-5-methylphenyl)ethyl]-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: 3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[1-(2-methoxy-5-methyl-phenyl)ethyl]propionamide Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N5O3/c1-12-5-6-16(27-4)14(9-12)13(2)22-17(25)7-8-24-11-20-18-15(19(24)26)10-21-23(18)3/h5-6,9-11,13H,7-8H2,1-4H3,(H,22,25)