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Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-[(4-chlorophenyl)imino]-6,7-dihydro-1,3-dimethyl-6-phenyl-
SpectraBase Compound ID GPrLMy3FnV8
InChI InChI=1S/C20H16ClN5O2/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/h3-12H,1-2H3/b22-19+
InChIKey PAWPOXTUNILCQM-ZBJSNUHESA-N
Mol Weight 393.83 g/mol
Molecular Formula C20H16ClN5O2
Exact Mass 393.099252 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDZVunVrAD8
Name Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-[(4-chlorophenyl)imino]-6,7-dihydro-1,3-dimethyl-6-phenyl-
CAS Registry Number 132124-88-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16ClN5O2
InChI InChI=1S/C20H16ClN5O2/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/h3-12H,1-2H3/b22-19+
InChIKey PAWPOXTUNILCQM-ZBJSNUHESA-N
Molecular Weight 393.834 g/mol
SMILES C=12C(C(=O)N(C(N2C)=O)C)=CN(\C(N1)=N\c1ccc(cc1)Cl)c1ccccc1
SPLASH splash10-004i-2901000000-97fd81ed43ebf1048ff1
Source of Spectrum F-46-7860-4
Synonyms (7Z)-7-[(4-chlorophenyl)imino]-1,3-dimethyl-6-phenyl-6,7-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione 7-(p-chlorophenyl)imino-6-phenyl-1,3-dimethyl-2,4-dioxo-1,2,3,4,6,7-hexadropyrimido[4,5-d]pyrimide
Wiley ID 1366224