2-[methyl-[[3-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioic S-acid

Systemtic Name: 2-[methyl-[[3-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioic S-acid Openeye Name: 2-[methyl-[[3-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioic S-acid CAS Name: 2-[methyl-[[3-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioic S-acid IUPAC Name: 2-[methyl-[[3-(trifluoromethyl)phenyl]methylsulfonyl]amino]ethanethioic S-acid Traditional Name: 2-[methyl-[3-(trifluoromethyl)benzyl]sulfonyl-amino]thioacetic acid Formula: C11H12F3NO3S2 MolecularWeight: 327.34309

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)S)S(=O)(=O)CC1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

CN(CC(=O)S)S(=O)(=O)CC1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C11H12F3NO3S2/c1-15(6-10(16)19)20(17,18)7-8-3-2-4-9(5-8)11(12,13)14/h2-5H,6-7H2,1H3,(H,16,19)