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

Systemtic Name: 1,3-thiazol-4-yl 3-[(2,5-dimethoxyphenyl)amino]-5-methylsulfanyl-thiophene-2-carboxylate hydrobromide Openeye Name: thiazol-4-yl 3-(2,5-dimethoxyanilino)-5-methylsulfanyl-thiophene-2-carboxylate hydrobromide CAS Name: 3-(2,5-dimethoxyanilino)-5-(methylthio)-2-thiophenecarboxylic acid 4-thiazolyl ester hydrobromide IUPAC Name: 1,3-thiazol-4-yl 3-(2,5-dimethoxyanilino)-5-methylsulfanylthiophene-2-carboxylate hydrobromide Traditional Name: 3-(2,5-dimethoxyanilino)-5-(methylthio)thiophene-2-carboxylic acid thiazol-4-yl ester hydrobromide Formula: C17H17BrN2O4S3 MolecularWeight: 489.42688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC2=C(SC(=C2)SC)C(=O)OC3=CSC=N3.Br

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC2=C(SC(=C2)SC)C(=O)OC3=CSC=N3.Br

InChI

InChI=1S/C17H16N2O4S3.BrH/c1-21-10-4-5-13(22-2)11(6-10)19-12-7-15(24-3)26-16(12)17(20)23-14-8-25-9-18-14;/h4-9,19H,1-3H3;1H