methyl 5-methylsulfanyl-4-[2-[(2-propan-2-ylphenyl)amino]-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide

Systemtic Name: methyl 5-methylsulfanyl-4-[2-[(2-propan-2-ylphenyl)amino]-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide Openeye Name: methyl 4-[2-(2-isopropylanilino)thiazol-4-yl]-5-methylsulfanyl-thiophene-2-carboxylate hydrobromide CAS Name: 5-(methylthio)-4-[2-(2-propan-2-ylanilino)-4-thiazolyl]-2-thiophenecarboxylic acid methyl ester hydrobromide IUPAC Name: methyl 5-methylsulfanyl-4-[2-(2-propan-2-ylanilino)-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide Traditional Name: 4-[2-(2-isopropylanilino)thiazol-4-yl]-5-(methylthio)thiophene-2-carboxylic acid methyl ester hydrobromide Formula: C19H21BrN2O2S3 MolecularWeight: 485.48124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC2=NC(=CS2)C3=C(SC(=C3)C(=O)OC)SC.Br

Isomeric SMILES

CC(C)C1=CC=CC=C1NC2=NC(=CS2)C3=C(SC(=C3)C(=O)OC)SC.Br

InChI

InChI=1S/C19H20N2O2S3.BrH/c1-11(2)12-7-5-6-8-14(12)20-19-21-15(10-25-19)13-9-16(17(22)23-3)26-18(13)24-4;/h5-11H,1-4H3,(H,20,21);1H