S-(2-azanylethyl) N-ethylcarbamothioate; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: S-(2-azanylethyl) N-ethylcarbamothioate; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: S-(2-aminoethyl) N-ethylcarbamothioate; 2,2,2-trifluoroacetic acid CAS Name: N-ethylcarbamothioic acid S-(2-aminoethyl) ester; 2,2,2-trifluoroacetic acid IUPAC Name: S-(2-aminoethyl) N-ethylcarbamothioate; 2,2,2-trifluoroacetic acid Traditional Name: N-ethylthiocarbamic acid S-(2-aminoethyl) ester; 2,2,2-trifluoroacetic acid Formula: C7H13F3N2O3S MolecularWeight: 262.24993

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)SCCN.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCNC(=O)SCCN.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C5H12N2OS.C2HF3O2/c1-2-7-5(8)9-4-3-6;3-2(4,5)1(6)7/h2-4,6H2,1H3,(H,7,8);(H,6,7)