#14;4-[5-[[2-(2-ACETYLAMINO-2-CARBOXYETHANESULFINYL]-ETHYL]-[2-(2-AMINO-2-CARBOXYETHYLSULFANYL)-ETHYL]-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACID
Compound with spectra: 1 NMR
![#14;4-[5-[[2-(2-ACETYLAMINO-2-CARBOXYETHANESULFINYL]-ETHYL]-[2-(2-AMINO-2-CARBOXYETHYLSULFANYL)-ETHYL]-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACID](/api/compound/BbXnND41far.png?ph=true&h=300&w=458 "#14;4-[5-[[2-(2-ACETYLAMINO-2-CARBOXYETHANESULFINYL]-ETHYL]-[2-(2-AMINO-2-CARBOXYETHYLSULFANYL)-ETHYL]-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACID")
| SpectraBase Compound ID | BbXnND41far |
|---|---|
| InChI | InChI=1S/2C24H35N5O8S2/c2*1-15(30)26-19(24(35)36)13-38-10-8-29(9-11-39(37)14-17(25)23(33)34)16-6-7-20-18(12-16)27-21(28(20)2)4-3-5-22(31)32/h2*6-7,12,17,19H,3-5,8-11,13-14,25H2,1-2H3,(H,26,30)(H,31,32)(H,33,34)(H,35,36)/t2*17-,19-,39?/m00/s1 |
| InChIKey | ULZGBJZOZXRZLA-LDOBOEBESA-N |
| Mol Weight | 1171.4 g/mol |
| Molecular Formula | C48H70N10O16S4 |
| Exact Mass | 1170.385411 g/mol |
| Enantiomer InChIKey | ULZGBJZOZXRZLA-VORGQEJRSA-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-CHLOROETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACID
4-[5-[[2-(2-ACETYLAMINO-2-CARBOXYETHANESULFINYL]-ETHYL]-(2-HYDROXYETHYL)-AMINO]-1-METHYL-1H-BENZOIMIDAZOL-2-YL]-BUTANOIC-ACID
3-pyridinecarboxamide, 6-chloro-N-[3-[5-[(2-furanylcarbonyl)amino]-1-methyl-1H-benzimidazol-2-yl]propyl]-
3-pyridinecarboxamide, 6-chloro-N-[2-[5-[(2-furanylcarbonyl)amino]-1-methyl-1H-benzimidazol-2-yl]ethyl]-
2-furancarboxamide, N-[2-[5-[[2-(2-chlorophenoxy)acetyl]amino]-1-methyl-1H-benzimidazol-2-yl]ethyl]tetrahydro-
3-pyridinecarboxamide, 6-chloro-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]-
propanamide, N-[1-methyl-2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-1H-benzimidazol-5-yl]-3-(phenylsulfonyl)-
propanamide, N-[2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1-methyl-1H-benzimidazol-5-yl]-3-(phenylsulfonyl)-
3-pyridinecarboxamide, 5-bromo-N-[2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1-methyl-1H-benzimidazol-5-yl]-
| 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 |