(2S)-2-azaniumyl-3-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]sulfanyl-propanoate

Systemtic Name: (2S)-2-azaniumyl-3-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]sulfanyl-propanoate Openeye Name: (2S)-3-[2-(allylamino)-2-oxo-ethyl]sulfanyl-2-azaniumyl-propanoate CAS Name: (2S)-2-ammonio-3-[[2-oxo-2-(prop-2-enylamino)ethyl]thio]propanoate IUPAC Name: (2S)-2-azaniumyl-3-[2-oxo-2-(prop-2-enylamino)ethyl]sulfanylpropanoate Traditional Name: (2S)-3-[[2-(allylamino)-2-keto-ethyl]thio]-2-ammonio-propionate Formula: C8H14N2O3S MolecularWeight: 218.27336

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CSCC(C(=O)[O-])[NH3+]

Isomeric SMILES

C=CCNC(=O)CSC[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C8H14N2O3S/c1-2-3-10-7(11)5-14-4-6(9)8(12)13/h2,6H,1,3-5,9H2,(H,10,11)(H,12,13)/t6-/m1/s1