2-[(3-nitrophenyl)methylsulfanyl]-1-(phenylsulfonyl)-4,5-dihydroimidazole

Systemtic Name: 2-[(3-nitrophenyl)methylsulfanyl]-1-(phenylsulfonyl)-4,5-dihydroimidazole Openeye Name: 1-(benzenesulfonyl)-2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazole CAS Name: 1-(benzenesulfonyl)-2-[(3-nitrophenyl)methylthio]-4,5-dihydroimidazole IUPAC Name: 1-(benzenesulfonyl)-2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazole Traditional Name: 1-besyl-2-[(3-nitrobenzyl)thio]-2-imidazoline Formula: C16H15N3O4S2 MolecularWeight: 377.438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O4S2/c20-19(21)14-6-4-5-13(11-14)12-24-16-17-9-10-18(16)25(22,23)15-7-2-1-3-8-15/h1-8,11H,9-10,12H2