[2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(2-chloranyl-5-nitro-phenyl)methanone

Systemtic Name: [2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(2-chloranyl-5-nitro-phenyl)methanone Openeye Name: [2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(2-chloro-5-nitro-phenyl)methanone CAS Name: [2-[(4-bromophenyl)methylthio]-4,5-dihydroimidazol-1-yl]-(2-chloro-5-nitrophenyl)methanone IUPAC Name: [2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(2-chloro-5-nitrophenyl)methanone Traditional Name: [2-[(4-bromobenzyl)thio]-2-imidazolin-1-yl]-(2-chloro-5-nitro-phenyl)methanone Formula: C17H13BrClN3O3S MolecularWeight: 454.72542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13BrClN3O3S/c18-12-3-1-11(2-4-12)10-26-17-20-7-8-21(17)16(23)14-9-13(22(24)25)5-6-15(14)19/h1-6,9H,7-8,10H2