2-(4-nitrophenyl)-1-[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone

Systemtic Name: 2-(4-nitrophenyl)-1-[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone Openeye Name: 2-(4-nitrophenyl)-1-[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone CAS Name: 2-(4-nitrophenyl)-1-[2-[(3-nitrophenyl)methylthio]-4,5-dihydroimidazol-1-yl]ethanone IUPAC Name: 2-(4-nitrophenyl)-1-[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone Traditional Name: 1-[2-[(3-nitrobenzyl)thio]-2-imidazolin-1-yl]-2-(4-nitrophenyl)ethanone Formula: C18H16N4O5S MolecularWeight: 400.40844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O5S/c23-17(11-13-4-6-15(7-5-13)21(24)25)20-9-8-19-18(20)28-12-14-2-1-3-16(10-14)22(26)27/h1-7,10H,8-9,11-12H2