2-[2-(3-ethoxypropylamino)-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[2-(3-ethoxypropylamino)-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-(3-ethoxypropylamino)-2-oxo-ethyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[2-(3-ethoxypropylamino)-2-oxoethyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[2-(3-ethoxypropylamino)-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-(3-ethoxypropylamino)-2-keto-ethyl]-4-methyl-thiazole-5-carboxylic acid Formula: C12H18N2O4S MolecularWeight: 286.34732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)CC1=NC(=C(S1)C(=O)O)C

Isomeric SMILES

CCOCCCNC(=O)CC1=NC(=C(S1)C(=O)O)C

InChI

InChI=1S/C12H18N2O4S/c1-3-18-6-4-5-13-9(15)7-10-14-8(2)11(19-10)12(16)17/h3-7H2,1-2H3,(H,13,15)(H,16,17)