4-(azepan-1-ylcarbonyl)-1,2,5-trimethyl-N-[4-(trifluoromethyloxy)phenyl]pyrrole-3-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-1,2,5-trimethyl-N-[4-(trifluoromethyloxy)phenyl]pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-1,2,5-trimethyl-N-[4-(trifluoromethoxy)phenyl]-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrole-3-sulfonamide Formula: C21H26F3N3O4S MolecularWeight: 473.50905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)NC2=CC=C(C=C2)OC(F)(F)F)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)NC2=CC=C(C=C2)OC(F)(F)F)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H26F3N3O4S/c1-14-18(20(28)27-12-6-4-5-7-13-27)19(15(2)26(14)3)32(29,30)25-16-8-10-17(11-9-16)31-21(22,23)24/h8-11,25H,4-7,12-13H2,1-3H3