2-Pyrrolidinecarbonitrile, 4-fluoro-1-[2-[[(1R,3S)-3-(1H-1,2,4-triazol-1-ylmethyl)cyclopentyl]amino]acetyl]-, (2S,4S)-, methanesulfonate (1:1)
CAS Registry Number®
869368-93-4
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CAS Name
2-Pyrrolidinecarbonitrile, 4-fluoro-1-[2-[[(1R,3S)-3-(1H-1,2,4-triazol-1-ylmethyl)cyclopentyl]amino]acetyl]-, (2S,4S)-, methanesulfonate (1:1)Molecular Formula
C15H21FN6O.CH4O3SCite this Page
2-Pyrrolidinecarbonitrile, 4-fluoro-1-[2-[[(1R,3S)-3-(1H-1,2,4-triazol-1-ylmethyl)cyclopentyl]amino]acetyl]-, (2S,4S)-, methanesulfonate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=869368-93-4 (retrieved ) (CAS RN: 869368-93-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C15H21FN6O.CH4O3S/c16-12-4-14(5-17)22(8-12)15(23)6-19-13-2-1-11(3-13)7-21-10-18-9-20-21;1-5(2,3)4/h9-14,19H,1-4,6-8H2;1H3,(H,2,3,4)/t11-,12-,13+,14-;/m0./s1
InChIKey
InChIKey=IAWFHPXSNMKWIL-QVYXHAGSSA-N
SMILES
C(CN[C@H]1C[C@@H](CN2C=NC=N2)CC1)(=O)N3[C@H](C#N)C[C@H](F)C3.S(C)(=O)(=O)O
Canonical SMILES
N#CC1N(C(=O)CNC2CCC(CN3N=CN=C3)C2)CC(F)C1.O=S(=O)(O)C
Other Names for this Substance
- 2-Pyrrolidinecarbonitrile, 4-fluoro-1-[2-[[(1R,3S)-3-(1H-1,2,4-triazol-1-ylmethyl)cyclopentyl]amino]acetyl]-, (2S,4S)-, methanesulfonate (1:1)
- 2-Pyrrolidinecarbonitrile, 4-fluoro-1-[[[(1R,3S)-3-(1H-1,2,4-triazol-1-ylmethyl)cyclopentyl]amino]acetyl]-, (2S,4S)-, monomethanesulfonate
- Melogliptin mesylate
