ethyl 2,5-dimethyl-4-[2-[2-(4-methylphenoxy)ethylsulfanyl]ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-[2-(4-methylphenoxy)ethylsulfanyl]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-[2-(4-methylphenoxy)ethylsulfanyl]acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[2-[2-(4-methylphenoxy)ethylthio]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-[2-(4-methylphenoxy)ethylsulfanyl]acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-4-[2-[2-(4-methylphenoxy)ethylthio]acetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CSCCOC2=CC=C(C=C2)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CSCCOC2=CC=C(C=C2)C)C)C

InChI

InChI=1S/C20H25NO4S/c1-5-24-20(23)19-15(4)21-14(3)18(19)17(22)12-26-11-10-25-16-8-6-13(2)7-9-16/h6-9,21H,5,10-12H2,1-4H3