2-[[2-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methylsulfanyl]propanoic acid

Systemtic Name: 2-[[2-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methylsulfanyl]propanoic acid Openeye Name: 2-[[2-[2-(dimethylamino)-2-oxo-ethyl]thiazol-4-yl]methylsulfanyl]propanoic acid CAS Name: 2-[[2-[2-(dimethylamino)-2-oxoethyl]-4-thiazolyl]methylthio]propanoic acid IUPAC Name: 2-[[2-[2-(dimethylamino)-2-oxoethyl]-1,3-thiazol-4-yl]methylsulfanyl]propanoic acid Traditional Name: 2-[[2-[2-(dimethylamino)-2-keto-ethyl]thiazol-4-yl]methylthio]propionic acid Formula: C11H16N2O3S2 MolecularWeight: 288.38634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=CSC(=N1)CC(=O)N(C)C

Isomeric SMILES

CC(C(=O)O)SCC1=CSC(=N1)CC(=O)N(C)C

InChI

InChI=1S/C11H16N2O3S2/c1-7(11(15)16)17-5-8-6-18-9(12-8)4-10(14)13(2)3/h6-7H,4-5H2,1-3H3,(H,15,16)