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2-[Benzoyl-(4-chloro-phenyl)-amino]-3-propyl-3,4-dihydro-quinazoline-4-carboxylic acid tert-butylamide
SpectraBase Compound ID D3wIdM4nSHm
InChI InChI=1S/C29H31ClN4O2/c1-5-19-33-25(26(35)32-29(2,3)4)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/h6-18,25H,5,19H2,1-4H3,(H,32,35)
InChIKey WWSBNZGPVHERGT-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 2F2wU5fZJ7t
Name 2-[Benzoyl-(4-chloro-phenyl)-amino]-3-propyl-3,4-dihydro-quinazoline-4-carboxylic acid tert-butylamide
Alternate Name(s) N-tert-Butyl-2-[N-(4-chlorophenyl)benzamido]-3-propyl-3,4-dihydroquinazoline-4-carboxamide 2-(N-benzoyl-4-chloroanilino)-N-tert-butyl-3-propyl-4H-quinazoline-4-carboxamide N-tert-butyl-2-[(4-chlorophenyl)-(phenylcarbonyl)amino]-3-propyl-4H-quinazoline-4-carboxamide
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Formula C29H31ClN4O2
InChI InChI=1S/C29H31ClN4O2/c1-5-19-33-25(26(35)32-29(2,3)4)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/h6-18,25H,5,19H2,1-4H3,(H,32,35)
InChIKey WWSBNZGPVHERGT-UHFFFAOYSA-N
Molecular Weight 503.046 g/mol
SMILES N(C(C1N(C(N(C(=O)c2ccccc2)c2ccc(cc2)Cl)=Nc2c1cccc2)CCC)=O)C(C)(C)C
SPLASH splash10-114i-0970900000-7f8b693a00029cffa80d
Source of Spectrum U1-2010-1092-4d
Wiley ID 1663399