1-[5-(4-fluorophenyl)-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butan-1-one

Systemtic Name: 1-[5-(4-fluorophenyl)-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butan-1-one Openeye Name: 1-[5-(4-fluorophenyl)-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butan-1-one CAS Name: 1-[5-(4-fluorophenyl)-3-(6-quinoxalinyl)-3,4-dihydropyrazol-2-yl]-1-butanone IUPAC Name: 1-[5-(4-fluorophenyl)-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butan-1-one Traditional Name: 1-[3-(4-fluorophenyl)-5-quinoxalin-6-yl-2-pyrazolin-1-yl]butan-1-one Formula: C21H19FN4O MolecularWeight: 362.400163

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(CC(=N1)C2=CC=C(C=C2)F)C3=CC4=NC=CN=C4C=C3

Isomeric SMILES

CCCC(=O)N1C(CC(=N1)C2=CC=C(C=C2)F)C3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C21H19FN4O/c1-2-3-21(27)26-20(13-18(25-26)14-4-7-16(22)8-5-14)15-6-9-17-19(12-15)24-11-10-23-17/h4-12,20H,2-3,13H2,1H3