2,2,2-tris(chloranyl)-1-[5-(4-methoxyphenyl)sulfanyl-1H-pyrrol-2-yl]ethanone

Systemtic Name: 2,2,2-tris(chloranyl)-1-[5-(4-methoxyphenyl)sulfanyl-1H-pyrrol-2-yl]ethanone Openeye Name: 2,2,2-trichloro-1-[5-(4-methoxyphenyl)sulfanyl-1H-pyrrol-2-yl]ethanone CAS Name: 2,2,2-trichloro-1-[5-[(4-methoxyphenyl)thio]-1H-pyrrol-2-yl]ethanone IUPAC Name: 2,2,2-trichloro-1-[5-(4-methoxyphenyl)sulfanyl-1H-pyrrol-2-yl]ethanone Traditional Name: 2,2,2-trichloro-1-[5-[(4-methoxyphenyl)thio]-1H-pyrrol-2-yl]ethanone Formula: C13H10Cl3NO2S MolecularWeight: 350.648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=CC=C(N2)C(=O)C(Cl)(Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)SC2=CC=C(N2)C(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C13H10Cl3NO2S/c1-19-8-2-4-9(5-3-8)20-11-7-6-10(17-11)12(18)13(14,15)16/h2-7,17H,1H3