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

Systemtic Name: 1,3-thiazol-4-yl 3-[(2-chlorophenyl)amino]-5-methylsulfanyl-thiophene-2-carboxylate hydrobromide Openeye Name: thiazol-4-yl 3-(2-chloroanilino)-5-methylsulfanyl-thiophene-2-carboxylate hydrobromide CAS Name: 3-(2-chloroanilino)-5-(methylthio)-2-thiophenecarboxylic acid 4-thiazolyl ester hydrobromide IUPAC Name: 1,3-thiazol-4-yl 3-(2-chloroanilino)-5-methylsulfanylthiophene-2-carboxylate hydrobromide Traditional Name: 3-(2-chloroanilino)-5-(methylthio)thiophene-2-carboxylic acid thiazol-4-yl ester hydrobromide Formula: C15H12BrClN2O2S3 MolecularWeight: 463.81998

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(S1)C(=O)OC2=CSC=N2)NC3=CC=CC=C3Cl.Br

Isomeric SMILES

CSC1=CC(=C(S1)C(=O)OC2=CSC=N2)NC3=CC=CC=C3Cl.Br

InChI

InChI=1S/C15H11ClN2O2S3.BrH/c1-21-13-6-11(18-10-5-3-2-4-9(10)16)14(23-13)15(19)20-12-7-22-8-17-12;/h2-8,18H,1H3;1H