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N-[3-(aminocarbonyl)-4,5-dimethyl-2-thienyl]-2-(2,4-dimethoxyphenyl)-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

N-[3-(aminocarbonyl)-4,5-dimethyl-2-thienyl]-2-(2,4-dimethoxyphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID FchmMJJ95Pw
InChI InChI=1S/C25H23N3O4S/c1-13-14(2)33-25(22(13)23(26)29)28-24(30)18-12-20(27-19-8-6-5-7-16(18)19)17-10-9-15(31-3)11-21(17)32-4/h5-12H,1-4H3,(H2,26,29)(H,28,30)
InChIKey AZUHOZSFKRUVAI-UHFFFAOYSA-N
Mol Weight 461.54 g/mol
Molecular Formula C25H23N3O4S
Exact Mass 461.140927 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 56vVMMh7lyg
Name N-[3-(Aminocarbonyl)-4,5-dimethyl-2-thienyl]-2-(2,4-dimethoxyphenyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 461.140927403 u
Formula C25H23N3O4S
InChI InChI=1S/C25H23N3O4S/c1-13-14(2)33-25(22(13)23(26)29)28-24(30)18-12-20(27-19-8-6-5-7-16(18)19)17-10-9-15(31-3)11-21(17)32-4/h5-12H,1-4H3,(H2,26,29)(H,28,30)
InChIKey AZUHOZSFKRUVAI-UHFFFAOYSA-N
Molecular Weight 461.536 g/mol
SMILES NC(C1=C(SC(=C1C)C)NC(C=1C=C(C2=C(C=C(C=C2)OC)OC)N=C2C1C=CC=C2)=O)=O