4-(2-bromanyl-4-chloranyl-3-methylsulfanyl-phenyl)-N-(quinolin-4-ylmethyl)benzenesulfonamide

Systemtic Name: 4-(2-bromanyl-4-chloranyl-3-methylsulfanyl-phenyl)-N-(quinolin-4-ylmethyl)benzenesulfonamide Openeye Name: 4-(2-bromo-4-chloro-3-methylsulfanyl-phenyl)-N-(4-quinolylmethyl)benzenesulfonamide CAS Name: 4-[2-bromo-4-chloro-3-(methylthio)phenyl]-N-(4-quinolinylmethyl)benzenesulfonamide IUPAC Name: 4-(2-bromo-4-chloro-3-methylsulfanylphenyl)-N-(quinolin-4-ylmethyl)benzenesulfonamide Traditional Name: 4-[2-bromo-4-chloro-3-(methylthio)phenyl]-N-(4-quinolylmethyl)benzenesulfonamide Formula: C23H18BrClN2O2S2 MolecularWeight: 533.88822

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1Br)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=NC4=CC=CC=C34)Cl

Isomeric SMILES

CSC1=C(C=CC(=C1Br)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=NC4=CC=CC=C34)Cl

InChI

InChI=1S/C23H18BrClN2O2S2/c1-30-23-20(25)11-10-19(22(23)24)15-6-8-17(9-7-15)31(28,29)27-14-16-12-13-26-21-5-3-2-4-18(16)21/h2-13,27H,14H2,1H3