(2R)-3-(1H-imidazol-5-yl)-2-(2-methylsulfanylethanoylamino)propanoic acid

Systemtic Name: (2R)-3-(1H-imidazol-5-yl)-2-(2-methylsulfanylethanoylamino)propanoic acid Openeye Name: (2R)-3-(1H-imidazol-5-yl)-2-[(2-methylsulfanylacetyl)amino]propanoic acid CAS Name: (2R)-3-(1H-imidazol-5-yl)-2-[[2-(methylthio)-1-oxoethyl]amino]propanoic acid IUPAC Name: (2R)-3-(1H-imidazol-5-yl)-2-[(2-methylsulfanylacetyl)amino]propanoic acid Traditional Name: (2R)-3-(1H-imidazol-5-yl)-2-[[2-(methylthio)acetyl]amino]propionic acid Formula: C9H13N3O3S MolecularWeight: 243.28282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)NC(CC1=CN=CN1)C(=O)O

Isomeric SMILES

CSCC(=O)N[C@H](CC1=CN=CN1)C(=O)O

InChI

InChI=1S/C9H13N3O3S/c1-16-4-8(13)12-7(9(14)15)2-6-3-10-5-11-6/h3,5,7H,2,4H2,1H3,(H,10,11)(H,12,13)(H,14,15)/t7-/m1/s1