4-[5-[[2-(2-ACETYLAMINO-2-CARBOXYETHANESULFINYL]-ETHYL]-(2-CHLOROETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACID
Compound with spectra: 1 NMR
![4-[5-[[2-(2-ACETYLAMINO-2-CARBOXYETHANESULFINYL]-ETHYL]-(2-CHLOROETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACID](/api/compound/BCTSXOuPkP5.png?ph=true&h=300&w=458 "4-[5-[[2-(2-ACETYLAMINO-2-CARBOXYETHANESULFINYL]-ETHYL]-(2-CHLOROETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACID")
| SpectraBase Compound ID | BCTSXOuPkP5 |
|---|---|
| InChI | InChI=1S/2C21H29ClN4O6S/c2*1-14(27)23-17(21(30)31)13-33(32)11-10-26(9-8-22)15-6-7-18-16(12-15)24-19(25(18)2)4-3-5-20(28)29/h2*6-7,12,17H,3-5,8-11,13H2,1-2H3,(H,23,27)(H,28,29)(H,30,31)/t2*17-,33?/m00/s1 |
| InChIKey | JHIMCOYEBJOFAJ-SOXGLTPUSA-N |
| Mol Weight | 1002.0 g/mol |
| Molecular Formula | C42H58Cl2N8O12S2 |
| Exact Mass | 1000.299267 g/mol |
| Enantiomer InChIKey | JHIMCOYEBJOFAJ-YDPWBRBUSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
4-[5-[[2-(2-ACETYLAMINO-2-CARBOXYETHANESULFINYL]-ETHYL]-(2-HYDROXYETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACID
2-furancarboxamide, N-[2-[5-[(2-furanylcarbonyl)amino]-1-methyl-1H-benzimidazol-2-yl]ethyl]tetrahydro-
2-furancarboxamide, N-[2-[5-[[2-(2-chlorophenoxy)acetyl]amino]-1-methyl-1H-benzimidazol-2-yl]ethyl]tetrahydro-
2-furancarboxamide, tetrahydro-N-[2-[1-methyl-5-[(2-thienylcarbonyl)amino]-1H-benzimidazol-2-yl]ethyl]-
3-pyridinecarboxamide, 6-chloro-N-[3-[1-methyl-5-[(phenylsulfonyl)amino]-1H-benzimidazol-2-yl]propyl]-
3-pyridinecarboxamide, 6-chloro-N-[2-[5-[(2-furanylcarbonyl)amino]-1-methyl-1H-benzimidazol-2-yl]ethyl]-
3-pyridinecarboxamide, 6-chloro-N-[2-[1-methyl-5-[(2-thienylcarbonyl)amino]-1H-benzimidazol-2-yl]ethyl]-
N-{2-[2-(benzoylamino)ethyl]-1-methyl-1H-benzimidazol-5-yl}-2-methylbenzamide
3-pyridinecarboxamide, 6-chloro-N-[2-[5-[(cyclohexylcarbonyl)amino]-1-methyl-1H-benzimidazol-2-yl]ethyl]-
propanamide, N-[2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1-methyl-1H-benzimidazol-5-yl]-3-(phenylsulfonyl)-
| 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 |