1-ethyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylthio]benzimidazole-5-sulfonamide Formula: C17H16N4O3S3 MolecularWeight: 420.52894

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C17H16N4O3S3/c1-2-21-14-6-5-12(27(18,22)23)9-13(14)19-17(21)26-10-11-8-15(24-20-11)16-4-3-7-25-16/h3-9H,2,10H2,1H3,(H2,18,22,23)