1-ethyl-2-[2-(3-nitrophenoxy)ethylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-2-[2-(3-nitrophenoxy)ethylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[2-(3-nitrophenoxy)ethylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[2-(3-nitrophenoxy)ethylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[2-(3-nitrophenoxy)ethylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[2-(3-nitrophenoxy)ethylthio]benzimidazole-5-sulfonamide Formula: C17H18N4O5S2 MolecularWeight: 422.47862

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCCOC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCCOC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O5S2/c1-2-20-16-7-6-14(28(18,24)25)11-15(16)19-17(20)27-9-8-26-13-5-3-4-12(10-13)21(22)23/h3-7,10-11H,2,8-9H2,1H3,(H2,18,24,25)