5,6-dimethoxy-2-(5-methoxy-2-nitro-phenyl)sulfanyl-1H-benzimidazole

Systemtic Name: 5,6-dimethoxy-2-(5-methoxy-2-nitro-phenyl)sulfanyl-1H-benzimidazole Openeye Name: 5,6-dimethoxy-2-(5-methoxy-2-nitro-phenyl)sulfanyl-1H-benzimidazole CAS Name: 5,6-dimethoxy-2-[(5-methoxy-2-nitrophenyl)thio]-1H-benzimidazole IUPAC Name: 5,6-dimethoxy-2-(5-methoxy-2-nitrophenyl)sulfanyl-1H-benzimidazole Traditional Name: 5,6-dimethoxy-2-[(5-methoxy-2-nitro-phenyl)thio]-1H-benzimidazole Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)[N+](=O)[O-])SC2=NC3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[N+](=O)[O-])SC2=NC3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C16H15N3O5S/c1-22-9-4-5-12(19(20)21)15(6-9)25-16-17-10-7-13(23-2)14(24-3)8-11(10)18-16/h4-8H,1-3H3,(H,17,18)