3-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[1-(2,5-dimethylthiazol-4-yl)ethylamino]-3-(2-thienyl)propanoic acid CAS Name: 3-[1-(2,5-dimethyl-4-thiazolyl)ethylamino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[1-(2,5-dimethylthiazol-4-yl)ethylamino]-3-(2-thienyl)propionic acid Formula: C14H18N2O2S2 MolecularWeight: 310.43492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C)C(C)NC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

CC1=C(N=C(S1)C)C(C)NC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C14H18N2O2S2/c1-8(14-9(2)20-10(3)16-14)15-11(7-13(17)18)12-5-4-6-19-12/h4-6,8,11,15H,7H2,1-3H3,(H,17,18)