1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-phenylsulfanyl-ethanone

Systemtic Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-phenylsulfanyl-ethanone Openeye Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-phenylsulfanyl-ethanone CAS Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-(phenylthio)ethanone IUPAC Name: 1-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-phenylsulfanylethanone Traditional Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(phenylthio)ethanone Formula: C20H18BrNOS MolecularWeight: 400.33202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C20H18BrNOS/c1-14-12-19(20(23)13-24-18-6-4-3-5-7-18)15(2)22(14)17-10-8-16(21)9-11-17/h3-12H,13H2,1-2H3