3-(4-fluorophenyl)sulfonyl-N-[4-isothiocyanato-3-(trifluoromethyl)phenyl]-2-methyl-2-oxidanyl-propanamide

Systemtic Name: 3-(4-fluorophenyl)sulfonyl-N-[4-isothiocyanato-3-(trifluoromethyl)phenyl]-2-methyl-2-oxidanyl-propanamide Openeye Name: 3-(4-fluorophenyl)sulfonyl-2-hydroxy-N-[4-isothiocyanato-3-(trifluoromethyl)phenyl]-2-methyl-propanamide CAS Name: 3-(4-fluorophenyl)sulfonyl-2-hydroxy-N-[4-isothiocyanato-3-(trifluoromethyl)phenyl]-2-methylpropanamide IUPAC Name: 3-(4-fluorophenyl)sulfonyl-2-hydroxy-N-[4-isothiocyanato-3-(trifluoromethyl)phenyl]-2-methylpropanamide Traditional Name: 3-(4-fluorophenyl)sulfonyl-2-hydroxy-N-[4-isothiocyanato-3-(trifluoromethyl)phenyl]-2-methyl-propionamide Formula: C18H14F4N2O4S2 MolecularWeight: 462.438373

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C1=CC=C(C=C1)F)(C(=O)NC2=CC(=C(C=C2)N=C=S)C(F)(F)F)O

Isomeric SMILES

CC(CS(=O)(=O)C1=CC=C(C=C1)F)(C(=O)NC2=CC(=C(C=C2)N=C=S)C(F)(F)F)O

InChI

InChI=1S/C18H14F4N2O4S2/c1-17(26,9-30(27,28)13-5-2-11(19)3-6-13)16(25)24-12-4-7-15(23-10-29)14(8-12)18(20,21)22/h2-8,26H,9H2,1H3,(H,24,25)