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

Systemtic Name: N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-ethyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-ethyl-N-(3-fluoro-4-methoxy-benzyl)-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C19H22FN5O3 MolecularWeight: 387.408083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22FN5O3/c1-4-24(11-13-5-6-16(28-3)15(20)9-13)17(26)7-8-25-12-21-18-14(19(25)27)10-22-23(18)2/h5-6,9-10,12H,4,7-8,11H2,1-3H3