Ciprokiren

Molecular Formula: C₃₇H₅₅N₅O₈S

InChI: InChI=1/C37H55N5O8S/c1-37(2,36(47)42-15-17-50-18-16-42)51(48,49)23-28(19-25-9-5-3-6-10-25)34(45)41-31(21-29-22-38-24-39-29)35(46)40-30(20-26-11-7-4-8-12-26)33(44)32(43)27-13-14-27/h3,5-6,9-10,22,24,26-28,30-33,43-44H,4,7-8,11-21,23H2,1-2H3,(H,38,39)(H,40,46)(H,41,45)/t28-,30+,31+,32+,33?/m1/s1/f/h39-41H

InChIKey: InChIKey=PODHJNNUGIBMOP-YNEKRCMQDC
SMILES: CC(C)(C(=O)N1CCOCC1)S(=O)(=O)CC(CC2=CC=CC=C2)C(=O)NC(CC3=CN=CN3)C(=O)NC(CC4CCCCC4)C(C(C5CC5)O)O

Names:
    Ciprokiren [INN]
    Ciprokiren
    (alphaS)-N-((1S,2R,3S)-1-(Cyclohexylmethyl)-3-cyclopropyl-2,3-dihydroxypropyl)-alpha-((alphaS)-alpha-(((1-methyl-1-(morpholinocarbonyl)ethyl)sulfonyl)methyl)hydrocinnamamido)imidazole-4-propionamide
    (2R)-2-benzyl-N-[(1S)-1-[[(2S,4S)-1-cyclohexyl-4-cyclopropyl-3,4-dihydroxy-butan-2-yl]carbamoyl]-2-(3H-imidazol-4-yl)ethyl]-3-(2-methyl-1-morpholin-4-yl-1-oxo-propan-2-yl)sulfonyl-propanamide
    1H-Imidazole-4-propanamide, N-(1-(cyclohexylmethyl)-3-cyclopropyl-2,3-dihydroxypropyl)-alpha-((2-(((1,1-dimethyl-2-(4-morpholinyl)-2-oxoethyl)sulfonyl)methyl)-1-oxo-3-phenylpropyl)amino)-, (1S-(1R*,(R*(R*)),2S*,3R*))-
    143631-62-3

Registries:
    PubChem CID 64925
    PubChem ID 206858