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2-(3-benzyl-2,4-diketo-6,7-dimethoxy-quinazolin-1-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
SpectraBase Compound ID I8m17QxGeHI
InChI InChI=1S/C26H21ClF3N3O5/c1-37-21-11-17-20(12-22(21)38-2)32(25(36)33(24(17)35)13-15-6-4-3-5-7-15)14-23(34)31-19-10-16(26(28,29)30)8-9-18(19)27/h3-12H,13-14H2,1-2H3,(H,31,34)
InChIKey LYAQEEKETBVEBU-UHFFFAOYSA-N
Mol Weight 547.92 g/mol
Molecular Formula C26H21ClF3N3O5
Exact Mass 547.112183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXpP0O2gVaD
Name 2-(3-benzyl-2,4-diketo-6,7-dimethoxy-quinazolin-1-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H21ClF3N3O5
InChI InChI=1S/C26H21ClF3N3O5/c1-37-21-11-17-20(12-22(21)38-2)32(25(36)33(24(17)35)13-15-6-4-3-5-7-15)14-23(34)31-19-10-16(26(28,29)30)8-9-18(19)27/h3-12H,13-14H2,1-2H3,(H,31,34)
InChIKey LYAQEEKETBVEBU-UHFFFAOYSA-N
Molecular Weight 547.918 g/mol
SMILES N(c1cc(C(F)(F)F)ccc1Cl)C(CN1C(N(C(c2c1cc(c(c2)OC)OC)=O)Cc1ccccc1)=O)=O
SPLASH splash10-0006-9700000000-7ad92904c58ee6e7359c
Synonyms 2-(3-benzyl-6,7-dimethoxy-2,4-dioxo-quinazolin-1-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-[6,7-dimethoxy-2,4-bis(oxidanylidene)-3-(phenylmethyl)quinazolin-1-yl]ethanamide N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6,7-dimethoxy-2,4-dioxo-3-(phenylmethyl)-1-quinazolinyl]acetamide
Wiley ID 1445441