(2S)-2-azanyl-3-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]sulfanyl-propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]sulfanyl-propanoic acid Openeye Name: (2S)-2-amino-3-[2-oxo-2-(prop-2-ynylamino)ethyl]sulfanyl-propanoic acid CAS Name: (2S)-2-amino-3-[[2-oxo-2-(prop-2-ynylamino)ethyl]thio]propanoic acid IUPAC Name: (2S)-2-amino-3-[2-oxo-2-(prop-2-ynylamino)ethyl]sulfanylpropanoic acid Traditional Name: (2S)-2-amino-3-[[2-keto-2-(propargylamino)ethyl]thio]propionic acid Formula: C8H12N2O3S MolecularWeight: 216.25748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C#CCNC(=O)CSC[C@H](C(=O)O)N

InChI

InChI=1S/C8H12N2O3S/c1-2-3-10-7(11)5-14-4-6(9)8(12)13/h1,6H,3-5,9H2,(H,10,11)(H,12,13)/t6-/m1/s1