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

Systemtic Name: 4-azanyl-3-(3,4-dimethoxyphenyl)-1,2-thiazole-5-carboxylic acid Openeye Name: 4-amino-3-(3,4-dimethoxyphenyl)isothiazole-5-carboxylic acid CAS Name: 4-amino-3-(3,4-dimethoxyphenyl)-5-isothiazolecarboxylic acid IUPAC Name: 4-amino-3-(3,4-dimethoxyphenyl)-1,2-thiazole-5-carboxylic acid Traditional Name: 4-amino-3-(3,4-dimethoxyphenyl)isothiazole-5-carboxylic acid Formula: C12H12N2O4S MolecularWeight: 280.29968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NSC(=C2N)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NSC(=C2N)C(=O)O)OC

InChI

InChI=1S/C12H12N2O4S/c1-17-7-4-3-6(5-8(7)18-2)10-9(13)11(12(15)16)19-14-10/h3-5H,13H2,1-2H3,(H,15,16)