2-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-N,1-dibutyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-N,1-dibutyl-benzimidazole-5-sulfonamide Openeye Name: 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-N,1-dibutyl-benzimidazole-5-sulfonamide CAS Name: 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylthio]-N,1-dibutyl-5-benzimidazolesulfonamide IUPAC Name: 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-N,1-dibutylbenzimidazole-5-sulfonamide Traditional Name: 2-[[4-amino-6-(dimethylamino)-s-triazin-2-yl]methylthio]-N,1-dibutyl-benzimidazole-5-sulfonamide Formula: C21H32N8O2S2 MolecularWeight: 492.66118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=NC(=NC(=N3)N(C)C)N)CCCC

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=NC(=NC(=N3)N(C)C)N)CCCC

InChI

InChI=1S/C21H32N8O2S2/c1-5-7-11-23-33(30,31)15-9-10-17-16(13-15)24-21(29(17)12-8-6-2)32-14-18-25-19(22)27-20(26-18)28(3)4/h9-10,13,23H,5-8,11-12,14H2,1-4H3,(H2,22,25,26,27)