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Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-[(4-fluorophenyl)amino]-5,6-dihydro-1,3-dimethyl-6-phenyl-
SpectraBase Compound ID CgEFtdte5hi
InChI InChI=1S/C20H18FN5O2/c1-24-17-16(18(27)25(2)20(24)28)12-26(15-6-4-3-5-7-15)19(23-17)22-14-10-8-13(21)9-11-14/h3-11H,12H2,1-2H3,(H,22,23)
InChIKey NPTNTQYHEXUYJJ-UHFFFAOYSA-N
Mol Weight 379.4 g/mol
Molecular Formula C20H18FN5O2
Exact Mass 379.144453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4y72lGVq16
Name Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-[(4-fluorophenyl)amino]-5,6-dihydro-1,3-dimethyl-6-phenyl-
CAS Registry Number 132124-99-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18FN5O2
InChI InChI=1S/C20H18FN5O2/c1-24-17-16(18(27)25(2)20(24)28)12-26(15-6-4-3-5-7-15)19(23-17)22-14-10-8-13(21)9-11-14/h3-11H,12H2,1-2H3,(H,22,23)
InChIKey NPTNTQYHEXUYJJ-UHFFFAOYSA-N
Molecular Weight 379.395 g/mol
SMILES N(C1=NC2=C(C(=O)N(C(N2C)=O)C)CN1c1ccccc1)c1ccc(cc1)F
SPLASH splash10-004i-9627000000-32635cc0c40dfa472b82
Source of Spectrum F-46-7863-6
Synonyms 7-(4-fluoroanilino)-1,3-dimethyl-6-phenyl-5,6-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione 7-(p-fluorophenyl)amino-6-phenyl-1,3-dimethyl-1,2,3,4,5,6-hexahydropyrimido[4,5-d]pyrimidine
Wiley ID 1359241