N-[3-(4-methyl-1,4-diazepan-1-yl)quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[3-(4-methyl-1,4-diazepan-1-yl)quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-(4-methyl-1,4-diazepan-1-yl)quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-(4-methyl-1,4-diazepan-1-yl)-2-quinoxalinyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-(4-methyl-1,4-diazepan-1-yl)quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-(4-methyl-1,4-diazepan-1-yl)quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide Formula: C21H22F3N5O2S MolecularWeight: 465.49189

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CN1CCCN(CC1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H22F3N5O2S/c1-28-11-6-12-29(14-13-28)20-19(25-16-8-3-4-9-17(16)26-20)27-32(30,31)18-10-5-2-7-15(18)21(22,23)24/h2-5,7-10H,6,11-14H2,1H3,(H,25,27)