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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN=C2SCC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN=C2SCC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

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