N-butan-2-yl-3-[1-(4-fluorophenyl)-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]propanamide

Systemtic Name: N-butan-2-yl-3-[1-(4-fluorophenyl)-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]propanamide Openeye Name: 3-[1-(4-fluorophenyl)-6-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]-N-sec-butyl-propanamide CAS Name: N-butan-2-yl-3-[1-(4-fluorophenyl)-6-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]propanamide IUPAC Name: N-butan-2-yl-3-[1-(4-fluorophenyl)-6-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]propanamide Traditional Name: 3-[1-(4-fluorophenyl)-4-keto-6-methyl-pyrazolo[3,4-d]pyrimidin-5-yl]-N-sec-butyl-propionamide Formula: C19H22FN5O2 MolecularWeight: 371.408683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22FN5O2/c1-4-12(2)22-17(26)9-10-24-13(3)23-18-16(19(24)27)11-21-25(18)15-7-5-14(20)6-8-15/h5-8,11-12H,4,9-10H2,1-3H3,(H,22,26)