1-butyl-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methylthio]benzimidazole-5-sulfonamide Formula: C17H23N5O3S2 MolecularWeight: 409.52622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NC(=NO3)C(C)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NC(=NO3)C(C)C

InChI

InChI=1S/C17H23N5O3S2/c1-4-5-8-22-14-7-6-12(27(18,23)24)9-13(14)19-17(22)26-10-15-20-16(11(2)3)21-25-15/h6-7,9,11H,4-5,8,10H2,1-3H3,(H2,18,23,24)