2-[2-(cyanomethylamino)-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-(cyanomethylamino)-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(cyanomethylamino)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-(cyanomethylamino)-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-(cyanomethylamino)-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-(cyanomethylamino)-2-keto-ethyl]thio]acetic acid Formula: C6H8N2O3S MolecularWeight: 188.20432

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)NC(=O)CSCC(=O)O

Isomeric SMILES

C(C#N)NC(=O)CSCC(=O)O

InChI

InChI=1S/C6H8N2O3S/c7-1-2-8-5(9)3-12-4-6(10)11/h2-4H2,(H,8,9)(H,10,11)