2-(1H-benzimidazol-2-ylsulfanylmethyl)-N,N-diethyl-3H-benzimidazole-5-sulfonamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-N,N-diethyl-3H-benzimidazole-5-sulfonamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-N,N-diethyl-3H-benzimidazole-5-sulfonamide CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-N,N-diethyl-3H-benzimidazole-5-sulfonamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-N,N-diethyl-3H-benzimidazole-5-sulfonamide Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-N,N-diethyl-3H-benzimidazole-5-sulfonamide Formula: C19H21N5O2S2 MolecularWeight: 415.53234

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(N2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(N2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H21N5O2S2/c1-3-24(4-2)28(25,26)13-9-10-16-17(11-13)21-18(20-16)12-27-19-22-14-7-5-6-8-15(14)23-19/h5-11H,3-4,12H2,1-2H3,(H,20,21)(H,22,23)