dimethyl 3-(4-chlorophenyl)-1,2-thiazole-4,5-dicarboxylate

Systemtic Name: dimethyl 3-(4-chlorophenyl)-1,2-thiazole-4,5-dicarboxylate Openeye Name: dimethyl 3-(4-chlorophenyl)isothiazole-4,5-dicarboxylate CAS Name: 3-(4-chlorophenyl)isothiazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(4-chlorophenyl)-1,2-thiazole-4,5-dicarboxylate Traditional Name: 3-(4-chlorophenyl)isothiazole-4,5-dicarboxylic acid dimethyl ester Formula: C13H10ClNO4S MolecularWeight: 311.7408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SN=C1C2=CC=C(C=C2)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SN=C1C2=CC=C(C=C2)Cl)C(=O)OC

InChI

InChI=1S/C13H10ClNO4S/c1-18-12(16)9-10(7-3-5-8(14)6-4-7)15-20-11(9)13(17)19-2/h3-6H,1-2H3