1-(2-methoxyphenyl)-2-(2-methylpropylsulfanyl)-5-nitro-benzimidazole

Systemtic Name: 1-(2-methoxyphenyl)-2-(2-methylpropylsulfanyl)-5-nitro-benzimidazole Openeye Name: 2-isobutylsulfanyl-1-(2-methoxyphenyl)-5-nitro-benzimidazole CAS Name: 1-(2-methoxyphenyl)-2-(2-methylpropylthio)-5-nitrobenzimidazole IUPAC Name: 1-(2-methoxyphenyl)-2-(2-methylpropylsulfanyl)-5-nitrobenzimidazole Traditional Name: 2-(isobutylthio)-1-(2-methoxyphenyl)-5-nitro-benzimidazole Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC2=C(N1C3=CC=CC=C3OC)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CSC1=NC2=C(N1C3=CC=CC=C3OC)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3S/c1-12(2)11-25-18-19-14-10-13(21(22)23)8-9-15(14)20(18)16-6-4-5-7-17(16)24-3/h4-10,12H,11H2,1-3H3