2-[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-[bis(2-cyanoethyl)amino]-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-[bis(2-cyanoethyl)amino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-[bis(2-cyanoethyl)amino]-2-keto-ethyl]thio]acetic acid Formula: C10H13N3O3S MolecularWeight: 255.29352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13N3O3S/c11-3-1-5-13(6-2-4-12)9(14)7-17-8-10(15)16/h1-2,5-8H2,(H,15,16)