4-[4-chloranyl-2-methyl-3-(trifluoromethylsulfonyl)phenyl]-N-(quinolin-4-ylmethyl)benzenesulfonamide

Systemtic Name: 4-[4-chloranyl-2-methyl-3-(trifluoromethylsulfonyl)phenyl]-N-(quinolin-4-ylmethyl)benzenesulfonamide Openeye Name: 4-[4-chloro-2-methyl-3-(trifluoromethylsulfonyl)phenyl]-N-(4-quinolylmethyl)benzenesulfonamide CAS Name: 4-[4-chloro-2-methyl-3-(trifluoromethylsulfonyl)phenyl]-N-(4-quinolinylmethyl)benzenesulfonamide IUPAC Name: 4-[4-chloro-2-methyl-3-(trifluoromethylsulfonyl)phenyl]-N-(quinolin-4-ylmethyl)benzenesulfonamide Traditional Name: 4-(4-chloro-2-methyl-3-triflyl-phenyl)-N-(4-quinolylmethyl)benzenesulfonamide Formula: C24H18ClF3N2O4S2 MolecularWeight: 554.98893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1S(=O)(=O)C(F)(F)F)Cl)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=NC4=CC=CC=C34

Isomeric SMILES

CC1=C(C=CC(=C1S(=O)(=O)C(F)(F)F)Cl)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C24H18ClF3N2O4S2/c1-15-19(10-11-21(25)23(15)35(31,32)24(26,27)28)16-6-8-18(9-7-16)36(33,34)30-14-17-12-13-29-22-5-3-2-4-20(17)22/h2-13,30H,14H2,1H3