ethyl 5-(4-chlorophenyl)-4-methylsulfanyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-4-methylsulfanyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-4-methylsulfanyl-1H-pyrrole-3-carboxylate CAS Name: 5-(4-chlorophenyl)-4-(methylthio)-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-4-methylsulfanyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(4-chlorophenyl)-4-(methylthio)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C14H14ClNO2S MolecularWeight: 295.78446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC(=C1SC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CNC(=C1SC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H14ClNO2S/c1-3-18-14(17)11-8-16-12(13(11)19-2)9-4-6-10(15)7-5-9/h4-8,16H,3H2,1-2H3