S-(2-azanylethyl) 4-(methylamino)butanethioate dihydrochloride

Systemtic Name: S-(2-azanylethyl) 4-(methylamino)butanethioate dihydrochloride Openeye Name: S-(2-aminoethyl) 4-(methylamino)butanethioate dihydrochloride CAS Name: 4-(methylamino)butanethioic acid S-(2-aminoethyl) ester dihydrochloride IUPAC Name: S-(2-aminoethyl) 4-(methylamino)butanethioate dihydrochloride Traditional Name: 4-(methylamino)butanethioic acid S-(2-aminoethyl) ester dihydrochloride Formula: C7H18Cl2N2OS MolecularWeight: 249.20162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCCCC(=O)SCCN.Cl.Cl

Isomeric SMILES

CNCCCC(=O)SCCN.Cl.Cl

InChI

InChI=1S/C7H16N2OS.2ClH/c1-9-5-2-3-7(10)11-6-4-8;;/h9H,2-6,8H2,1H3;2*1H