Benzimidazole, 1-(2-(diethylamino)ethyl)-2-((p-(ethylamino)phenyl)thio)-, trihydrochloride

diethyl-[2-[2-[4-(ethylazaniumyl)phenyl]sulfanyl-3H-benzimidazol-1-ium-1-yl]ethyl]azanium trichloride

CAS: 4929-82-2

Molecular Formula	`C21H31Cl3N4S`
Molecular Weight	477.9 g/mol
Topological Polar Surface Area	66.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	9
Exact Mass	476.1335
Heavy Atoms	29
Complexity	395.0

Chemical Identifiers

CAS Number	4929-82-2
SMILES	`CC[NH2+]C1=CC=C(C=C1)SC2=[N+](C3=CC=CC=C3N2)CC[NH+](CC)CC.[Cl-].[Cl-].[Cl-]`
InChIKey	`OBMVUGVBWJUFDD-UHFFFAOYSA-N`

📖 Product Overview

Benzimidazole, 1-(2-(diethylamino)ethyl)-2-((p-(ethylamino)phenyl)thio)-, trihydrochloride (CAS: 4929-82-2) is a chemical compound with molecular formula C21H31Cl3N4S and molecular weight 477.9 g/mol. Its IUPAC systematic name is diethyl-[2-[2-[4-(ethylazaniumyl)phenyl]sulfanyl-3H-benzimidazol-1-ium-1-yl]ethyl]azanium trichloride. Topological Polar Surface Area 66.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 9 Exact Mass 476.1335 Heavy Atoms 29 Complexity 395.0 InChI Key: OBMVUGVBWJUFDD-UHFFFAOYSA-N. SMILES: CC[NH2+]C1=CC=C(C=C1)SC2=[N+](C3=CC=CC=C3N2)CC[NH+](CC)CC.[Cl-].[Cl-].[Cl-].

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