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

Systemtic Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanone Openeye Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanone CAS Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-(1,3,4-thiadiazol-2-ylthio)ethanone IUPAC Name: 1-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanone Traditional Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(1,3,4-thiadiazol-2-ylthio)ethanone Formula: C16H14BrN3OS2 MolecularWeight: 408.33586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C(=O)CSC3=NN=CS3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C(=O)CSC3=NN=CS3

InChI

InChI=1S/C16H14BrN3OS2/c1-10-7-14(15(21)8-22-16-19-18-9-23-16)11(2)20(10)13-5-3-12(17)4-6-13/h3-7,9H,8H2,1-2H3