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N-(2,5-dimethoxyphenyl)-2-({[(4-fluoroanilino)carbonyl]amino}acetyl)hydrazinecarboxamide
SpectraBase Compound ID 8Z2lbuH5KRT
InChI InChI=1S/C18H20FN5O5/c1-28-13-7-8-15(29-2)14(9-13)22-18(27)24-23-16(25)10-20-17(26)21-12-5-3-11(19)4-6-12/h3-9H,10H2,1-2H3,(H,23,25)(H2,20,21,26)(H2,22,24,27)
InChIKey BJYGTCHADWUYTI-UHFFFAOYSA-N
Mol Weight 405.39 g/mol
Molecular Formula C18H20FN5O5
Exact Mass 405.144847 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KtnsfA7Q8A6
Name N-(2,5-Dimethoxyphenyl)-2-({[(4-fluoroanilino)carbonyl]amino}acetyl)hydrazinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 405.144846922 u
Formula C18H20FN5O5
InChI InChI=1S/C18H20FN5O5/c1-28-13-7-8-15(29-2)14(9-13)22-18(27)24-23-16(25)10-20-17(26)21-12-5-3-11(19)4-6-12/h3-9H,10H2,1-2H3,(H,23,25)(H2,20,21,26)(H2,22,24,27)
InChIKey BJYGTCHADWUYTI-UHFFFAOYSA-N
Molecular Weight 405.386 g/mol
SMILES N(C1=CC(=CC=C1OC)OC)C(NNC(CNC(NC1=CC=C(C=C1)F)=O)=O)=O