4-[(5-chloranyl-2-ethoxy-phenyl)methylsulfanyl]-2-methyl-5-nitro-1H-imidazole

Systemtic Name: 4-[(5-chloranyl-2-ethoxy-phenyl)methylsulfanyl]-2-methyl-5-nitro-1H-imidazole Openeye Name: 4-[(5-chloro-2-ethoxy-phenyl)methylsulfanyl]-2-methyl-5-nitro-1H-imidazole CAS Name: 4-[(5-chloro-2-ethoxyphenyl)methylthio]-2-methyl-5-nitro-1H-imidazole IUPAC Name: 4-[(5-chloro-2-ethoxyphenyl)methylsulfanyl]-2-methyl-5-nitro-1H-imidazole Traditional Name: 4-[(5-chloro-2-ethoxy-benzyl)thio]-2-methyl-5-nitro-1H-imidazole Formula: C13H14ClN3O3S MolecularWeight: 327.78656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)CSC2=C(NC(=N2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)CSC2=C(NC(=N2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H14ClN3O3S/c1-3-20-11-5-4-10(14)6-9(11)7-21-13-12(17(18)19)15-8(2)16-13/h4-6H,3,7H2,1-2H3,(H,15,16)