2-[(ethylcarbamothioylamino)methyl]-3,3,3-tris(fluoranyl)propanoic acid

Systemtic Name: 2-[(ethylcarbamothioylamino)methyl]-3,3,3-tris(fluoranyl)propanoic acid Openeye Name: 2-[(ethylcarbamothioylamino)methyl]-3,3,3-trifluoro-propanoic acid CAS Name: 2-[[[ethylamino(sulfanylidene)methyl]amino]methyl]-3,3,3-trifluoropropanoic acid IUPAC Name: 2-[(ethylcarbamothioylamino)methyl]-3,3,3-trifluoropropanoic acid Traditional Name: 2-[(ethylthiocarbamoylamino)methyl]-3,3,3-trifluoro-propionic acid Formula: C7H11F3N2O2S MolecularWeight: 244.23465

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC(C(=O)O)C(F)(F)F

Isomeric SMILES

CCNC(=S)NCC(C(=O)O)C(F)(F)F

InChI

InChI=1S/C7H11F3N2O2S/c1-2-11-6(15)12-3-4(5(13)14)7(8,9)10/h4H,2-3H2,1H3,(H,13,14)(H2,11,12,15)