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2-[2-(4-ethoxyphenyl)sulfanylbenzimidazol-1-yl]ethyl-diethyl-azanium chloride

2-[2-(4-ethoxyphenyl)sulfanylbenzimidazol-1-yl]ethyl-diethyl-azanium chloride

Systemtic Name:2-[2-(4-ethoxyphenyl)sulfanylbenzimidazol-1-yl]ethyl-diethyl-azanium chloride
Openeye Name:2-[2-(4-ethoxyphenyl)sulfanylbenzimidazol-1-yl]ethyl-diethyl-ammonium chloride
CAS Name:2-[2-[(4-ethoxyphenyl)thio]-1-benzimidazolyl]ethyl-diethylammonium chloride
IUPAC Name:2-[2-(4-ethoxyphenyl)sulfanylbenzimidazol-1-yl]ethyl-diethylazanium chloride
Traditional Name:diethyl-[2-[2-(p-phenetylthio)benzimidazol-1-yl]ethyl]ammonium chloride
Formula: C21H28ClN3OS
MolecularWeight: 405.98452
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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1SC3=CC=C(C=C3)OCC.[Cl-]


Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1SC3=CC=C(C=C3)OCC.[Cl-]


InChI

InChI=1S/C21H27N3OS.ClH/c1-4-23(5-2)15-16-24-20-10-8-7-9-19(20)22-21(24)26-18-13-11-17(12-14-18)25-6-3;/h7-14H,4-6,15-16H2,1-3H3;1H


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