methyl 5-(3,4-dichlorophenyl)sulfanyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-(3,4-dichlorophenyl)sulfanyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-(3,4-dichlorophenyl)sulfanyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(3,4-dichlorophenyl)thio]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(3,4-dichlorophenyl)sulfanyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(3,4-dichlorophenyl)thio]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C12H9Cl2NO2S MolecularWeight: 302.17636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC(=C1)SC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

COC(=O)C1=CNC(=C1)SC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C12H9Cl2NO2S/c1-17-12(16)7-4-11(15-6-7)18-8-2-3-9(13)10(14)5-8/h2-6,15H,1H3