4-[(4-methyl-5-prop-2-enoxycarbonyl-1,3-thiazol-2-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(4-methyl-5-prop-2-enoxycarbonyl-1,3-thiazol-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(5-allyloxycarbonyl-4-methyl-thiazol-2-yl)amino]-4-oxo-butanoate CAS Name: 4-[[4-methyl-5-[oxo(prop-2-enoxy)methyl]-2-thiazolyl]amino]-4-oxobutanoate IUPAC Name: 4-[(4-methyl-5-prop-2-enoxycarbonyl-1,3-thiazol-2-yl)amino]-4-oxobutanoate Traditional Name: 4-[(5-allyloxycarbonyl-4-methyl-thiazol-2-yl)amino]-4-keto-butyrate Formula: C12H13N2O5S- MolecularWeight: 297.30702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCC(=O)[O-])C(=O)OCC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCC(=O)[O-])C(=O)OCC=C

InChI

InChI=1S/C12H14N2O5S/c1-3-6-19-11(18)10-7(2)13-12(20-10)14-8(15)4-5-9(16)17/h3H,1,4-6H2,2H3,(H,16,17)(H,13,14,15)/p-1