3-[1-(4-fluorophenyl)-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-N-propyl-propanamide

Systemtic Name: 3-[1-(4-fluorophenyl)-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-N-propyl-propanamide Openeye Name: 3-[1-(4-fluorophenyl)-6-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]-N-propyl-propanamide CAS Name: 3-[1-(4-fluorophenyl)-6-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]-N-propylpropanamide IUPAC Name: 3-[1-(4-fluorophenyl)-6-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]-N-propylpropanamide Traditional Name: 3-[1-(4-fluorophenyl)-4-keto-6-methyl-pyrazolo[3,4-d]pyrimidin-5-yl]-N-propyl-propionamide Formula: C18H20FN5O2 MolecularWeight: 357.382103

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CCN1C(=NC2=C(C1=O)C=NN2C3=CC=C(C=C3)F)C

Isomeric SMILES

CCCNC(=O)CCN1C(=NC2=C(C1=O)C=NN2C3=CC=C(C=C3)F)C

InChI

InChI=1S/C18H20FN5O2/c1-3-9-20-16(25)8-10-23-12(2)22-17-15(18(23)26)11-21-24(17)14-6-4-13(19)5-7-14/h4-7,11H,3,8-10H2,1-2H3,(H,20,25)