2-azanyl-3-[2-(dibutylamino)-2-oxidanylidene-ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-(dibutylamino)-2-oxidanylidene-ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-(dibutylamino)-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-(dibutylamino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-(dibutylamino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-(dibutylamino)-2-keto-ethyl]thio]propionic acid Formula: C13H26N2O3S MolecularWeight: 290.42214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CSCC(C(=O)O)N

Isomeric SMILES

CCCCN(CCCC)C(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C13H26N2O3S/c1-3-5-7-15(8-6-4-2)12(16)10-19-9-11(14)13(17)18/h11H,3-10,14H2,1-2H3,(H,17,18)