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2-[Benzoyl-(4-chloro-phenyl)-amino]-3-isopropyl-3,4-dihydro-quinazoline-4-carboxylic acid tert-butylamide
SpectraBase Compound ID 1TxWkm5zeOi
InChI InChI=1S/C29H31ClN4O2/c1-19(2)33-25(26(35)32-29(3,4)5)23-13-9-10-14-24(23)31-28(33)34(22-17-15-21(30)16-18-22)27(36)20-11-7-6-8-12-20/h6-19,25H,1-5H3,(H,32,35)
InChIKey ZDSIZASSFHXZJY-UHFFFAOYSA-N
Mol Weight 503.05 g/mol
Molecular Formula C29H31ClN4O2
Exact Mass 502.213554 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G3aQy404Gic
Name 2-[Benzoyl-(4-chloro-phenyl)-amino]-3-isopropyl-3,4-dihydro-quinazoline-4-carboxylic acid tert-butylamide
Alternate Name(s) N-tert-Butyl-2-[N-(4-chlorophenyl)benzamido]-3-isopropyl-3,4-dihydroquinazoline-4-carboxamide 2-(N-benzoyl-4-chloroanilino)-N-tert-butyl-3-propan-2-yl-4H-quinazoline-4-carboxamide N-tert-butyl-2-[(4-chlorophenyl)-(phenylcarbonyl)amino]-3-propan-2-yl-4H-quinazoline-4-carboxamide
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Formula C29H31ClN4O2
InChI InChI=1S/C29H31ClN4O2/c1-19(2)33-25(26(35)32-29(3,4)5)23-13-9-10-14-24(23)31-28(33)34(22-17-15-21(30)16-18-22)27(36)20-11-7-6-8-12-20/h6-19,25H,1-5H3,(H,32,35)
InChIKey ZDSIZASSFHXZJY-UHFFFAOYSA-N
Molecular Weight 503.046 g/mol
SMILES N(C(C1N(C(N(C(=O)c2ccccc2)c2ccc(cc2)Cl)=Nc2c1cccc2)C(C)C)=O)C(C)(C)C
SPLASH splash10-0ufr-8050900000-d7cea98ef7fbd82d6839
Source of Spectrum U1-2010-1091-4a
Wiley ID 1663402