4-methyl-2-[(2-methylsulfanylphenyl)amino]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-methyl-2-[(2-methylsulfanylphenyl)amino]-1,3-thiazole-5-carboxylic acid Openeye Name: 4-methyl-2-(2-methylsulfanylanilino)thiazole-5-carboxylic acid CAS Name: 4-methyl-2-[2-(methylthio)anilino]-5-thiazolecarboxylic acid IUPAC Name: 4-methyl-2-(2-methylsulfanylanilino)-1,3-thiazole-5-carboxylic acid Traditional Name: 4-methyl-2-[2-(methylthio)anilino]thiazole-5-carboxylic acid Formula: C12H12N2O2S2 MolecularWeight: 280.36588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=CC=CC=C2SC)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)NC2=CC=CC=C2SC)C(=O)O

InChI

InChI=1S/C12H12N2O2S2/c1-7-10(11(15)16)18-12(13-7)14-8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H,13,14)(H,15,16)