1-butyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[(5-methylisoxazol-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[(5-methyl-3-isoxazolyl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[(5-methylisoxazol-3-yl)methylthio]benzimidazole-5-sulfonamide Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NOC(=C3)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NOC(=C3)C

InChI

InChI=1S/C16H20N4O3S2/c1-3-4-7-20-15-6-5-13(25(17,21)22)9-14(15)18-16(20)24-10-12-8-11(2)23-19-12/h5-6,8-9H,3-4,7,10H2,1-2H3,(H2,17,21,22)