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

Systemtic Name: 2-(3-methylphenyl)-1-[2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone Openeye Name: 2-(m-tolyl)-1-[2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone CAS Name: 2-(3-methylphenyl)-1-[2-[(4-nitrophenyl)methylthio]-4,5-dihydroimidazol-1-yl]ethanone IUPAC Name: 2-(3-methylphenyl)-1-[2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]ethanone Traditional Name: 2-(m-tolyl)-1-[2-[(4-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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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