5-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-1-[(4-methoxy-3-nitro-phenyl)methyl]-2-methyl-4-nitro-imidazole

Systemtic Name: 5-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-1-[(4-methoxy-3-nitro-phenyl)methyl]-2-methyl-4-nitro-imidazole Openeye Name: 5-[(5-chloro-2-methoxy-phenyl)methylsulfanyl]-1-[(4-methoxy-3-nitro-phenyl)methyl]-2-methyl-4-nitro-imidazole CAS Name: 5-[(5-chloro-2-methoxyphenyl)methylthio]-1-[(4-methoxy-3-nitrophenyl)methyl]-2-methyl-4-nitroimidazole IUPAC Name: 5-[(5-chloro-2-methoxyphenyl)methylsulfanyl]-1-[(4-methoxy-3-nitrophenyl)methyl]-2-methyl-4-nitroimidazole Traditional Name: 5-[(5-chloro-2-methoxy-benzyl)thio]-1-(4-methoxy-3-nitro-benzyl)-2-methyl-4-nitro-imidazole Formula: C20H19ClN4O6S MolecularWeight: 478.90606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC2=CC(=C(C=C2)OC)[N+](=O)[O-])SCC3=C(C=CC(=C3)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(N1CC2=CC(=C(C=C2)OC)[N+](=O)[O-])SCC3=C(C=CC(=C3)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClN4O6S/c1-12-22-19(25(28)29)20(32-11-14-9-15(21)5-7-17(14)30-2)23(12)10-13-4-6-18(31-3)16(8-13)24(26)27/h4-9H,10-11H2,1-3H3