4-azanyl-3-(4-ethoxyphenyl)-1,2-thiazole-5-carboxylic acid

Systemtic Name: 4-azanyl-3-(4-ethoxyphenyl)-1,2-thiazole-5-carboxylic acid Openeye Name: 4-amino-3-(4-ethoxyphenyl)isothiazole-5-carboxylic acid CAS Name: 4-amino-3-(4-ethoxyphenyl)-5-isothiazolecarboxylic acid IUPAC Name: 4-amino-3-(4-ethoxyphenyl)-1,2-thiazole-5-carboxylic acid Traditional Name: 4-amino-3-p-phenetyl-isothiazole-5-carboxylic acid Formula: C12H12N2O3S MolecularWeight: 264.30028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NSC(=C2N)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NSC(=C2N)C(=O)O

InChI

InChI=1S/C12H12N2O3S/c1-2-17-8-5-3-7(4-6-8)10-9(13)11(12(15)16)18-14-10/h3-6H,2,13H2,1H3,(H,15,16)