N-butyl-2-(2-oxidanylidenepropylsulfanyl)-3H-benzimidazole-5-sulfonamide

Systemtic Name: N-butyl-2-(2-oxidanylidenepropylsulfanyl)-3H-benzimidazole-5-sulfonamide Openeye Name: 2-acetonylsulfanyl-N-butyl-3H-benzimidazole-5-sulfonamide CAS Name: N-butyl-2-(2-oxopropylthio)-3H-benzimidazole-5-sulfonamide IUPAC Name: N-butyl-2-(2-oxopropylsulfanyl)-3H-benzimidazole-5-sulfonamide Traditional Name: 2-(acetonylthio)-N-butyl-3H-benzimidazole-5-sulfonamide Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC(=O)C

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC(=O)C

InChI

InChI=1S/C14H19N3O3S2/c1-3-4-7-15-22(19,20)11-5-6-12-13(8-11)17-14(16-12)21-9-10(2)18/h5-6,8,15H,3-4,7,9H2,1-2H3,(H,16,17)