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

Systemtic Name: 1,3-thiazol-4-yl 3-[(4-chloranyl-2-methyl-phenyl)amino]-5-methylsulfanyl-thiophene-2-carboxylate hydrobromide Openeye Name: thiazol-4-yl 3-(4-chloro-2-methyl-anilino)-5-methylsulfanyl-thiophene-2-carboxylate hydrobromide CAS Name: 3-(4-chloro-2-methylanilino)-5-(methylthio)-2-thiophenecarboxylic acid 4-thiazolyl ester hydrobromide IUPAC Name: 1,3-thiazol-4-yl 3-(4-chloro-2-methylanilino)-5-methylsulfanylthiophene-2-carboxylate hydrobromide Traditional Name: 3-(4-chloro-2-methyl-anilino)-5-(methylthio)thiophene-2-carboxylic acid thiazol-4-yl ester hydrobromide Formula: C16H14BrClN2O2S3 MolecularWeight: 477.84656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC2=C(SC(=C2)SC)C(=O)OC3=CSC=N3.Br

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC2=C(SC(=C2)SC)C(=O)OC3=CSC=N3.Br

InChI

InChI=1S/C16H13ClN2O2S3.BrH/c1-9-5-10(17)3-4-11(9)19-12-6-14(22-2)24-15(12)16(20)21-13-7-23-8-18-13;/h3-8,19H,1-2H3;1H