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5-[4-[[4-(Pyridin-2-yl)morpholin-2-yl]methoxy]phenylmethylene]thiazolidin-2,4-dione
SpectraBase Compound ID FjxwVVREXTG
InChI InChI=1S/C20H19N3O4S/c24-19-17(28-20(25)22-19)11-14-4-6-15(7-5-14)27-13-16-12-23(9-10-26-16)18-3-1-2-8-21-18/h1-8,11,16H,9-10,12-13H2,(H,22,24,25)/b17-11+
InChIKey XMNRXAOOSVSAOO-GZTJUZNOSA-N
Mol Weight 397.45 g/mol
Molecular Formula C20H19N3O4S
Exact Mass 397.109627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8e2jiYCGBej
Name 5-[4-[[4-(Pyridin-2-yl)morpholin-2-yl]methoxy]phenylmethylene]thiazolidin-2,4-dione
Comments Computed using HOSE algorithm
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Exact Mass 397.109627274 u
Formula C20H19N3O4S
InChI InChI=1S/C20H19N3O4S/c24-19-17(28-20(25)22-19)11-14-4-6-15(7-5-14)27-13-16-12-23(9-10-26-16)18-3-1-2-8-21-18/h1-8,11,16H,9-10,12-13H2,(H,22,24,25)/b17-11+
InChIKey XMNRXAOOSVSAOO-GZTJUZNOSA-N
Molecular Weight 397.449 g/mol
SMILES C1(NC(\C(S1)=C/C=1C=CC(OCC2CN(C3=NC=CC=C3)CCO2)=CC1)=O)=O