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2-{5-[4-(4,6-Di-morpholin-4-yl-[1,3,5]triazin-2-ylamino)-phenyl]-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl}-N-p-tolylacetamide
SpectraBase Compound ID FuoQG73iV8o
InChI InChI=1S/C29H34N10O3S/c1-20-3-7-22(8-4-20)30-24(40)19-43-29-36-35-25(37(29)2)21-5-9-23(10-6-21)31-26-32-27(38-11-15-41-16-12-38)34-28(33-26)39-13-17-42-18-14-39/h3-10H,11-19H2,1-2H3,(H,30,40)(H,31,32,33,34)
InChIKey DWRGNSGBTAMHEN-UHFFFAOYSA-N
Mol Weight 602.7 g/mol
Molecular Formula C29H34N10O3S
Exact Mass 602.253606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Vlv0Xn2AzZ
Name 2-{5-[4-(4,6-Di-morpholin-4-yl-[1,3,5]triazin-2-ylamino)-phenyl]-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl}-N-p-tolylacetamide
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Formula C29H34N10O3S
InChI InChI=1S/C29H34N10O3S/c1-20-3-7-22(8-4-20)30-24(40)19-43-29-36-35-25(37(29)2)21-5-9-23(10-6-21)31-26-32-27(38-11-15-41-16-12-38)34-28(33-26)39-13-17-42-18-14-39/h3-10H,11-19H2,1-2H3,(H,30,40)(H,31,32,33,34)
InChIKey DWRGNSGBTAMHEN-UHFFFAOYSA-N
Molecular Weight 602.718 g/mol
SMILES N(C(CSc1[n](c(-c2ccc(Nc3nc(N4CCOCC4)nc(n3)N3CCOCC3)cc2)nn1)C)=O)c1ccc(cc1)C
SPLASH splash10-0udi-0000119000-bd589efdfa65eb492cd4
Source of Spectrum Y-45-1219-8c
Wiley ID 1666379