ethyl 2-[1-methyl-5-(4-methylsulfanylphenyl)pyrrol-2-yl]ethanoate

Systemtic Name: ethyl 2-[1-methyl-5-(4-methylsulfanylphenyl)pyrrol-2-yl]ethanoate Openeye Name: ethyl 2-[1-methyl-5-(4-methylsulfanylphenyl)pyrrol-2-yl]acetate CAS Name: 2-[1-methyl-5-[4-(methylthio)phenyl]-2-pyrrolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-methyl-5-(4-methylsulfanylphenyl)pyrrol-2-yl]acetate Traditional Name: 2-[1-methyl-5-[4-(methylthio)phenyl]pyrrol-2-yl]acetic acid ethyl ester Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(N1C)C2=CC=C(C=C2)SC

Isomeric SMILES

CCOC(=O)CC1=CC=C(N1C)C2=CC=C(C=C2)SC

InChI

InChI=1S/C16H19NO2S/c1-4-19-16(18)11-13-7-10-15(17(13)2)12-5-8-14(20-3)9-6-12/h5-10H,4,11H2,1-3H3