1-[2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-2-(4-nitrophenyl)ethanone

Systemtic Name: 1-[2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-2-(4-nitrophenyl)ethanone Openeye Name: 1-[2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-2-(4-nitrophenyl)ethanone CAS Name: 1-[2-[(4-bromophenyl)methylthio]-4,5-dihydroimidazol-1-yl]-2-(4-nitrophenyl)ethanone IUPAC Name: 1-[2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-2-(4-nitrophenyl)ethanone Traditional Name: 1-[2-[(4-bromobenzyl)thio]-2-imidazolin-1-yl]-2-(4-nitrophenyl)ethanone Formula: C18H16BrN3O3S MolecularWeight: 434.30694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=N1)SCC2=CC=C(C=C2)Br)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(C(=N1)SCC2=CC=C(C=C2)Br)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16BrN3O3S/c19-15-5-1-14(2-6-15)12-26-18-20-9-10-21(18)17(23)11-13-3-7-16(8-4-13)22(24)25/h1-8H,9-12H2