Cas no 70491-70-2 (4-Desmethoxy Omeprazole Sulfide)
70491-70-2 structure
Product Name:4-Desmethoxy Omeprazole Sulfide
CAS No:70491-70-2
MF:C16H17N3OS
MW:299.39068198204
CID:975228
Update Time:2023-08-02
4-Desmethoxy Omeprazole Sulfide Chemical and Physical Properties
Names and Identifiers
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- D-GLUCOSE(6-13C)
- D-GLUCOSE-6-13C
- 4-Desmethoxy Omeprazole Sulfide
- 2-[(3,5-dimethylpyridin-2-yl)methylsulfanyl]-6-methoxy-1H-benzimidazole
- 4-Desmethoxy Omeprazole Sulfide-[d3]
- 5-Methoxy-2-[[(3,5-dimethylpyridin-2-yl)methyl]sulphanyl]-1H-benzimidazole
- 2-[(3,5-dimethylpyridin-2-yl)methylsulfanyl]-5-methoxy-1H-benzimidazole
- 2-{[(3,5-Dimethylpyridin-2-yl)methyl]sulfanyl}-6-methoxy-1H-benzimidazole
-
- Inchi： 1S/C16H17N3OS/c1-10-6-11(2)15(17-8-10)9-21-16-18-13-5-4-12(20-3)7-14(13)19-16/h4-8H,9H2,1-3H3,(H,18,19)
- InChI Key： YTUHHMNQRUNZTP-UHFFFAOYSA-N
- SMILES： S(C1=NC2C=CC(=CC=2N1)OC)CC1C(C)=CC(C)=CN=1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 4
- Complexity: 344
- XLogP3: 3.5
- Topological Polar Surface Area: 76.1
4-Desmethoxy Omeprazole Sulfide Related Literature
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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