N-[5-(3-methyl-4-methylsulfanyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: N-[5-(3-methyl-4-methylsulfanyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: N-[5-(3-methyl-4-methylsulfanyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: N-[5-[3-methyl-4-(methylthio)phenyl]-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: N-[5-(3-methyl-4-methylsulfanylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: N-[5-[3-methyl-4-(methylthio)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C18H16F3N3O2S2 MolecularWeight: 427.46375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=NN2NS(=O)(=O)C3=CC=CC=C3)C(F)(F)F)SC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=NN2NS(=O)(=O)C3=CC=CC=C3)C(F)(F)F)SC

InChI

InChI=1S/C18H16F3N3O2S2/c1-12-10-13(8-9-16(12)27-2)15-11-17(18(19,20)21)22-24(15)23-28(25,26)14-6-4-3-5-7-14/h3-11,23H,1-2H3