2-azanylethyl N'-ethanoylcarbamimidothioate dihydrochloride

Systemtic Name: 2-azanylethyl N'-ethanoylcarbamimidothioate dihydrochloride Openeye Name: N-[amino(2-aminoethylsulfanyl)methylene]acetamide dihydrochloride CAS Name: N'-acetylcarbamimidothioic acid 2-aminoethyl ester dihydrochloride IUPAC Name: 2-aminoethyl N'-acetylcarbamimidothioate dihydrochloride Traditional Name: N-[amino-(2-aminoethylthio)methylene]acetamide dihydrochloride Formula: C5H13Cl2N3OS MolecularWeight: 234.14722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=C(N)SCCN.Cl.Cl

Isomeric SMILES

CC(=O)N=C(N)SCCN.Cl.Cl

InChI

InChI=1S/C5H11N3OS.2ClH/c1-4(9)8-5(7)10-3-2-6;;/h2-3,6H2,1H3,(H2,7,8,9);2*1H