(2S)-2-[2-(cyanomethylamino)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: (2S)-2-[2-(cyanomethylamino)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: (2S)-2-[2-(cyanomethylamino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: (2S)-2-[[2-(cyanomethylamino)-2-oxoethyl]thio]propanoic acid IUPAC Name: (2S)-2-[2-(cyanomethylamino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: (2S)-2-[[2-(cyanomethylamino)-2-keto-ethyl]thio]propionic acid Formula: C7H10N2O3S MolecularWeight: 202.2309

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)NCC#N

Isomeric SMILES

C[C@@H](C(=O)O)SCC(=O)NCC#N

InChI

InChI=1S/C7H10N2O3S/c1-5(7(11)12)13-4-6(10)9-3-2-8/h5H,3-4H2,1H3,(H,9,10)(H,11,12)/t5-/m0/s1