1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-6-fluoranyl-2-methyl-3,4-dihydro-2H-quinoline

Systemtic Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-6-fluoranyl-2-methyl-3,4-dihydro-2H-quinoline Openeye Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-6-fluoro-2-methyl-3,4-dihydro-2H-quinoline CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonyl]-6-fluoro-2-methyl-3,4-dihydro-2H-quinoline IUPAC Name: 1-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonyl-6-fluoro-2-methyl-3,4-dihydro-2H-quinoline Traditional Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-6-fluoro-2-methyl-3,4-dihydro-2H-quinoline Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(N1S(=O)(=O)C3=C(N(N=C3C)C4=CC=CC=C4)C)C=CC(=C2)F

Isomeric SMILES

CC1CCC2=C(N1S(=O)(=O)C3=C(N(N=C3C)C4=CC=CC=C4)C)C=CC(=C2)F

InChI

InChI=1S/C21H22FN3O2S/c1-14-9-10-17-13-18(22)11-12-20(17)25(14)28(26,27)21-15(2)23-24(16(21)3)19-7-5-4-6-8-19/h4-8,11-14H,9-10H2,1-3H3