N-[3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]quinoline-8-sulfonamide

Systemtic Name: N-[3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]quinoline-8-sulfonamide Openeye Name: N-[3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]quinoline-8-sulfonamide CAS Name: N-[3-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]propyl]-8-quinolinesulfonamide IUPAC Name: N-[3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]quinoline-8-sulfonamide Traditional Name: N-[3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]quinoline-8-sulfonamide Formula: C17H16BrF3N4O2S MolecularWeight: 477.29875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCNS(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1CCCNS(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(F)(F)F)Br

InChI

InChI=1S/C17H16BrF3N4O2S/c1-11-14(18)16(17(19,20)21)24-25(11)10-4-9-23-28(26,27)13-7-2-5-12-6-3-8-22-15(12)13/h2-3,5-8,23H,4,9-10H2,1H3