3-[[2-carbamothioyl-3-(trifluoromethyl)phenyl]amino]propanoic acid

Systemtic Name: 3-[[2-carbamothioyl-3-(trifluoromethyl)phenyl]amino]propanoic acid Openeye Name: 3-[2-carbamothioyl-3-(trifluoromethyl)anilino]propanoic acid CAS Name: 3-[2-carbamothioyl-3-(trifluoromethyl)anilino]propanoic acid IUPAC Name: 3-[2-carbamothioyl-3-(trifluoromethyl)anilino]propanoic acid Traditional Name: 3-[2-thiocarbamoyl-3-(trifluoromethyl)anilino]propionic acid Formula: C11H11F3N2O2S MolecularWeight: 292.27745

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)NCCC(=O)O)C(=S)N)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C(=C1)NCCC(=O)O)C(=S)N)C(F)(F)F

InChI

InChI=1S/C11H11F3N2O2S/c12-11(13,14)6-2-1-3-7(9(6)10(15)19)16-5-4-8(17)18/h1-3,16H,4-5H2,(H2,15,19)(H,17,18)