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2-[Benzoyl-(4-fluoro-phenyl)-amino]-3-ethyl-3,4-dihydro-quinazoline-4-carboxylic acid tert-butylamide
SpectraBase Compound ID 8Sl0rz4MLXk
InChI InChI=1S/C28H29FN4O2/c1-5-32-24(25(34)31-28(2,3)4)22-13-9-10-14-23(22)30-27(32)33(21-17-15-20(29)16-18-21)26(35)19-11-7-6-8-12-19/h6-18,24H,5H2,1-4H3,(H,31,34)
InChIKey STQJBHCSQNNYTP-UHFFFAOYSA-N
Mol Weight 472.56 g/mol
Molecular Formula C28H29FN4O2
Exact Mass 472.227454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bILKGmVHc
Name 2-[Benzoyl-(4-fluoro-phenyl)-amino]-3-ethyl-3,4-dihydro-quinazoline-4-carboxylic acid tert-butylamide
Alternate Name(s) N-(tert-Butyl)-3-ethyl-2-[N-(4-fluorophenyl)benzamido]-3,4-dihydroquinazoline-4-carboxamide 2-(N-benzoyl-4-fluoroanilino)-N-tert-butyl-3-ethyl-4H-quinazoline-4-carboxamide N-tert-butyl-3-ethyl-2-[(4-fluorophenyl)-(phenylcarbonyl)amino]-4H-quinazoline-4-carboxamide
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Formula C28H29FN4O2
InChI InChI=1S/C28H29FN4O2/c1-5-32-24(25(34)31-28(2,3)4)22-13-9-10-14-23(22)30-27(32)33(21-17-15-20(29)16-18-21)26(35)19-11-7-6-8-12-19/h6-18,24H,5H2,1-4H3,(H,31,34)
InChIKey STQJBHCSQNNYTP-UHFFFAOYSA-N
Molecular Weight 472.564 g/mol
SMILES N(C(C1N(C(N(C(=O)c2ccccc2)c2ccc(cc2)F)=Nc2c1cccc2)CC)=O)C(C)(C)C
SPLASH splash10-0aba-2903000000-f706be1d86fe898d2687
Source of Spectrum U1-2010-1092-4j
Wiley ID 1663393