2-(5-bromanyl-2-methylsulfanyl-phenyl)-1-pyrrol-1-yl-ethanone

Systemtic Name: 2-(5-bromanyl-2-methylsulfanyl-phenyl)-1-pyrrol-1-yl-ethanone Openeye Name: 2-(5-bromo-2-methylsulfanyl-phenyl)-1-pyrrol-1-yl-ethanone CAS Name: 2-[5-bromo-2-(methylthio)phenyl]-1-(1-pyrrolyl)ethanone IUPAC Name: 2-(5-bromo-2-methylsulfanylphenyl)-1-pyrrol-1-ylethanone Traditional Name: 2-[5-bromo-2-(methylthio)phenyl]-1-pyrrol-1-yl-ethanone Formula: C13H12BrNOS MolecularWeight: 310.20948

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)Br)CC(=O)N2C=CC=C2

Isomeric SMILES

CSC1=C(C=C(C=C1)Br)CC(=O)N2C=CC=C2

InChI

InChI=1S/C13H12BrNOS/c1-17-12-5-4-11(14)8-10(12)9-13(16)15-6-2-3-7-15/h2-8H,9H2,1H3