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Pyrimido[4,5-d]pyrimidin-4(1H)-one, 2,3,5,6,7,8-hexahydro-1-phenyl-6-(2-phenylethyl)-2-thioxo-
SpectraBase Compound ID 85WGs8QEr6p
InChI InChI=1S/C20H20N4OS/c25-19-17-13-23(12-11-15-7-3-1-4-8-15)14-21-18(17)24(20(26)22-19)16-9-5-2-6-10-16/h1-10,21H,11-14H2,(H,22,25,26)
InChIKey DFIKJZOTYPNOHG-UHFFFAOYSA-N
Mol Weight 364.47 g/mol
Molecular Formula C20H20N4OS
Exact Mass 364.135782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGfliNUCcwy
Name Pyrimido[4,5-d]pyrimidin-4(1H)-one, 2,3,5,6,7,8-hexahydro-1-phenyl-6-(2-phenylethyl)-2-thioxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N4OS
InChI InChI=1S/C20H20N4OS/c25-19-17-13-23(12-11-15-7-3-1-4-8-15)14-21-18(17)24(20(26)22-19)16-9-5-2-6-10-16/h1-10,21H,11-14H2,(H,22,25,26)
InChIKey DFIKJZOTYPNOHG-UHFFFAOYSA-N
Molecular Weight 364.467 g/mol
SMILES N1C(N(C2=C(C1=O)CN(CN2)CCc1ccccc1)c1ccccc1)=S
SPLASH splash10-0006-9100000000-aea9f2a7d6ec8474ad59
Source of Spectrum IY-2-4864-1
Synonyms 1-Phenyl-6-(2-phenylethyl)-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one 1-Phenyl-6-(2-phenylethyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one
Wiley ID 1656864