Melagatran hydroxyamidine
CAS Registry Number®
192939-72-3
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CAS Name
Melagatran hydroxyamidineMolecular Formula
C22H31N5O5Molecular Mass
445.51Cite this Page
Melagatran hydroxyamidine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=192939-72-3 (retrieved ) (CAS RN: 192939-72-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C22H31N5O5/c23-20(26-32)16-8-6-14(7-9-16)12-25-21(30)17-10-11-27(17)22(31)19(24-13-18(28)29)15-4-2-1-3-5-15/h6-9,15,17,19,24,32H,1-5,10-13H2,(H2,23,26)(H,25,30)(H,28,29)/t17-,19+/m0/s1
InChIKey
InChIKey=NIPUHXUEGZHFLD-PKOBYXMFSA-N
SMILES
C([C@H](NCC(O)=O)C1CCCCC1)(=O)N2[C@H](C(NCC3=CC=C(C(NO)=N)C=C3)=O)CC2
Canonical SMILES
O=C(O)CNC(C(=O)N1CCC1C(=O)NCC2=CC=C(C=C2)C(=N)NO)C3CCCCC3
Other Names for this Substance
- Glycine, N-[(1R)-1-cyclohexyl-2-[(2S)-2-[[[[4-[(hydroxyamino)iminomethyl]phenyl]methyl]amino]carbonyl]-1-azetidinyl]-2-oxoethyl]-
- N-[(1R)-1-Cyclohexyl-2-[(2S)-2-[[[[4-[(hydroxyamino)iminomethyl]phenyl]methyl]amino]carbonyl]-1-azetidinyl]-2-oxoethyl]glycine
- Melagatran hydroxyamidine
- N-Hydroxymelagatran
