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1-Benzyl-6-(furan-2-ylmethyl)-2-sulfanylidene-1H,2H,3H,4H,5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidin-4-one
SpectraBase Compound ID 2VUivrq4AuF
InChI InChI=1S/C18H18N4O2S/c23-17-15-11-21(10-14-7-4-8-24-14)12-19-16(15)22(18(25)20-17)9-13-5-2-1-3-6-13/h1-8,19H,9-12H2,(H,20,23,25)
InChIKey KDMIJIADGFITLV-UHFFFAOYSA-N
Mol Weight 354.43 g/mol
Molecular Formula C18H18N4O2S
Exact Mass 354.115047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HwOzfs1DVi
Name 1-Benzyl-6-(furan-2-ylmethyl)-2-sulfanylidene-1H,2H,3H,4H,5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidin-4-one
Alternate Name(s) Pyrimido[4,5-d]pyrimidin-4(1H)-one, 6-(2-furanylmethyl)-2,3,5,6,7,8-hexahydro-1-(phenylmethyl)-2-thioxo- 6-(2-furanylmethyl)-1-(phenylmethyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one 1-Benzyl-6-(furan-2-ylmethyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one 1-Benzyl-6-(2-furylmethyl)-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one 6-(furan-2-ylmethyl)-1-(phenylmethyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one
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Formula C18H18N4O2S
InChI InChI=1S/C18H18N4O2S/c23-17-15-11-21(10-14-7-4-8-24-14)12-19-16(15)22(18(25)20-17)9-13-5-2-1-3-6-13/h1-8,19H,9-12H2,(H,20,23,25)
InChIKey KDMIJIADGFITLV-UHFFFAOYSA-N
Molecular Weight 354.428 g/mol
SMILES N1CN(CC2=C1N(C(NC2=O)=S)Cc1ccccc1)Cc1occc1
SPLASH splash10-0f8c-9220000000-d3b3f7b9ecdcc4b8aafe
Source of Spectrum IY-2-5066-9
Wiley ID 1658652