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#2;4-[5-[[2-[2-(4-AMINO-4-CARBOXYBUTANOYLAMINO)-2-(CARBOXYMETHYLCARBAMOYL)-ETHYLSULFANYL]-ETHYL]-(2-CHLOROETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-

Compound with spectra: 1 NMR

#2;4-[5-[[2-[2-(4-AMINO-4-CARBOXYBUTANOYLAMINO)-2-(CARBOXYMETHYLCARBAMOYL)-ETHYLSULFANYL]-ETHYL]-(2-CHLOROETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-
SpectraBase Compound ID 5rSeHPajIDH
InChI InChI=1S/C26H37ClN6O8S/c1-32-20-7-5-16(13-18(20)30-21(32)3-2-4-23(35)36)33(10-9-27)11-12-42-15-19(25(39)29-14-24(37)38)31-22(34)8-6-17(28)26(40)41/h5,7,13,17,19H,2-4,6,8-12,14-15,28H2,1H3,(H,29,39)(H,31,34)(H,35,36)(H,37,38)(H,40,41)/t17-,19-/m0/s1
InChIKey UTRBKRUFUMZYCF-HKUYNNGSSA-N
Mol Weight 629.1 g/mol
Molecular Formula C26H37ClN6O8S
Exact Mass 628.208211 g/mol
Enantiomer InChIKey UTRBKRUFUMZYCF-IEBWSBKVSA-N

View Spectrum of #2;4-[5-[[2-[2-(4-AMINO-4-CARBOXYBUTANOYLAMINO)-2-(CARBOXYMETHYLCARBAMOYL)-ETHYLSULFANYL]-ETHYL]-(2-CHLOROETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-

13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
#3;4-[5-[BIS-[2-[2-(4-AMINO-4-CARBOXYBUTANOYLAMINO)-2-(CARBOXYMETHYLCARBAMOYL)-ETHYLSULFANYL]-ETHYL]-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACI
#4;4-[5-[[2-[2-(4-AMINO-4-CARBOXYBUTANOYLAMINO)-2-(CARBOXYMETHYLCARBAMOYL)-ETHYLSULFANYL]-ETHYL]-(2-HYDROXYETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]
benzamide, 3,4-dimethoxy-N-[1-methyl-2-(4-morpholinylmethyl)-1H-benzimidazol-5-yl]-
benzamide, 3,4,5-trimethoxy-N-[1-methyl-2-(4-morpholinylmethyl)-1H-benzimidazol-5-yl]-
benzamide, 3,4-dimethoxy-N-[1-methyl-2-(1-piperidinylmethyl)-1H-benzimidazol-5-yl]-
benzamide, 3,4,5-trimethoxy-N-[1-methyl-2-(1-piperidinylmethyl)-1H-benzimidazol-5-yl]-
N-Pyrrolidino protonitazene
sec-Butonitazene
N-[1-[2-(Diethylamino)ethyl]-2-(4-ethoxybenzyl)-1H-benzimidazol-5-yl]acetamide
Clonitazene
Title Journal or Book Year
Identification and Quantitation of theN-Acetyl-L-cysteineS-Conjugates of Bendamustine and Its Sulfoxides in Human Bile after Administration of Bendamustine Hydrochloride Drug Metabolism and Disposition 2008
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