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

Systemtic Name: 2-(3-methylphenyl)-1-[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone Openeye Name: 2-(m-tolyl)-1-[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone CAS Name: 2-(3-methylphenyl)-1-[2-[(3-nitrophenyl)methylthio]-4,5-dihydroimidazol-1-yl]ethanone IUPAC Name: 2-(3-methylphenyl)-1-[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone Traditional Name: 2-(m-tolyl)-1-[2-[(3-nitrobenzyl)thio]-2-imidazolin-1-yl]ethanone Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=O)N2CCN=C2SCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CC(=O)N2CCN=C2SCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O3S/c1-14-4-2-5-15(10-14)12-18(23)21-9-8-20-19(21)26-13-16-6-3-7-17(11-16)22(24)25/h2-7,10-11H,8-9,12-13H2,1H3