5-[(4-methylphenyl)amino]-2-methylsulfanyl-1,3-thiazole-4-carboxylic acid

Systemtic Name: 5-[(4-methylphenyl)amino]-2-methylsulfanyl-1,3-thiazole-4-carboxylic acid Openeye Name: 5-(4-methylanilino)-2-methylsulfanyl-thiazole-4-carboxylic acid CAS Name: 5-(4-methylanilino)-2-(methylthio)-4-thiazolecarboxylic acid IUPAC Name: 5-(4-methylanilino)-2-methylsulfanyl-1,3-thiazole-4-carboxylic acid Traditional Name: 2-(methylthio)-5-(p-toluidino)thiazole-4-carboxylic acid Formula: C12H12N2O2S2 MolecularWeight: 280.36588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(N=C(S2)SC)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(N=C(S2)SC)C(=O)O

InChI

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