N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]quinoline-8-sulfonamide

Systemtic Name: N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]quinoline-8-sulfonamide Openeye Name: N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]quinoline-8-sulfonamide CAS Name: N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-8-quinolinesulfonamide IUPAC Name: N-[1-[(2-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]quinoline-8-sulfonamide Traditional Name: N-[1-(2-fluorobenzyl)-3,5-dimethyl-pyrazol-4-yl]quinoline-8-sulfonamide Formula: C21H19FN4O2S MolecularWeight: 410.464563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2F)C)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2F)C)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H19FN4O2S/c1-14-20(15(2)26(24-14)13-17-7-3-4-10-18(17)22)25-29(27,28)19-11-5-8-16-9-6-12-23-21(16)19/h3-12,25H,13H2,1-2H3