For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(2-HYDROXY-3-(ISOPROPYLAMINO)-PROPYL)-5-METHYL-2-PHENYL-4-(2-THIENOYL)-1,2-DIHYDRO-PYRAZOL-3-ONE
SpectraBase Compound ID 1Ylndt5z5nI
InChI InChI=1S/C21H25N3O3S/c1-14(2)22-12-17(25)13-23-15(3)19(20(26)18-10-7-11-28-18)21(27)24(23)16-8-5-4-6-9-16/h4-11,14,17,22,25H,12-13H2,1-3H3
InChIKey HLLSNNTUXXLBMM-UHFFFAOYSA-N
Mol Weight 399.51 g/mol
Molecular Formula C21H25N3O3S
Exact Mass 399.161663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IJwnpU1yLBv
Name 1-(2-HYDROXY-3-(ISOPROPYLAMINO)-PROPYL)-5-METHYL-2-PHENYL-4-(2-THIENOYL)-1,2-DIHYDRO-PYRAZOL-3-ONE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H25N3O3S
InChI InChI=1S/C21H25N3O3S/c1-14(2)22-12-17(25)13-23-15(3)19(20(26)18-10-7-11-28-18)21(27)24(23)16-8-5-4-6-9-16/h4-11,14,17,22,25H,12-13H2,1-3H3
InChIKey HLLSNNTUXXLBMM-UHFFFAOYSA-N
Literature Reference Author P.CHIBA,W.HOLZER,M.LANDAU,G.BECHMANN,K.LORENZ,B.PLAGENS,M.HI TZLER,E.RICHTER,G.EC
Literature Reference Citation J.MED.CHEM.,41,4001(1998)
Literature Reference DOI 10.1021/jm980121y
Molecular Weight 399.508 g/mol
Solvent CDCl3
Source File Reference UWCP3854