[2-[(3-chlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-methyl-3-nitro-phenyl)methanone

Systemtic Name: [2-[(3-chlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-methyl-3-nitro-phenyl)methanone Openeye Name: [2-[(3-chlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-methyl-3-nitro-phenyl)methanone CAS Name: [2-[(3-chlorophenyl)methylthio]-4,5-dihydroimidazol-1-yl]-(4-methyl-3-nitrophenyl)methanone IUPAC Name: [2-[(3-chlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-methyl-3-nitrophenyl)methanone Traditional Name: [2-[(3-chlorobenzyl)thio]-2-imidazolin-1-yl]-(4-methyl-3-nitro-phenyl)methanone Formula: C18H16ClN3O3S MolecularWeight: 389.85594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN3O3S/c1-12-5-6-14(10-16(12)22(24)25)17(23)21-8-7-20-18(21)26-11-13-3-2-4-15(19)9-13/h2-6,9-10H,7-8,11H2,1H3