methyl 5-[2,4,5-tris(chloranyl)phenyl]sulfanyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2,4,5-tris(chloranyl)phenyl]sulfanyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-(2,4,5-trichlorophenyl)sulfanyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(2,4,5-trichlorophenyl)thio]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(2,4,5-trichlorophenyl)sulfanyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2,4,5-trichlorophenyl)thio]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C12H8Cl3NO2S MolecularWeight: 336.62142

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC(=C1)SC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

COC(=O)C1=CNC(=C1)SC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C12H8Cl3NO2S/c1-18-12(17)6-2-11(16-5-6)19-10-4-8(14)7(13)3-9(10)15/h2-5,16H,1H3