2-azanyl-3-[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-[bis(2-cyanoethyl)amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-[bis(2-cyanoethyl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-[bis(2-cyanoethyl)amino]-2-keto-ethyl]thio]propionic acid Formula: C11H16N4O3S MolecularWeight: 284.33474

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Descriptors Computed from Structure

Canonical SMILES:

C(CN(CCC#N)C(=O)CSCC(C(=O)O)N)C#N

Isomeric SMILES

C(CN(CCC#N)C(=O)CSCC(C(=O)O)N)C#N

InChI

InChI=1S/C11H16N4O3S/c12-3-1-5-15(6-2-4-13)10(16)8-19-7-9(14)11(17)18/h9H,1-2,5-8,14H2,(H,17,18)