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2-[4-(1,3-benzodioxol-5-yl)-3-cyano-6-(2,4-dimethoxyphenyl)-2-pyridinyl]guanidine
SpectraBase Compound ID I6Staqy20xo
InChI InChI=1S/C22H19N5O4/c1-28-13-4-5-14(19(8-13)29-2)17-9-15(16(10-23)21(26-17)27-22(24)25)12-3-6-18-20(7-12)31-11-30-18/h3-9H,11H2,1-2H3,(H4,24,25,26,27)
InChIKey ACCVVRUJDWQUME-UHFFFAOYSA-N
Mol Weight 417.43 g/mol
Molecular Formula C22H19N5O4
Exact Mass 417.143704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zLPBPcKVvm
Name 2-[4-(1,3-benzodioxol-5-yl)-3-cyano-6-(2,4-dimethoxyphenyl)-2-pyridinyl]guanidine
Alternate Name(s) 2-[4-(1,3-benzodioxol-5-yl)-3-cyano-6-(2,4-dimethoxyphenyl)-2-pyridyl]guanidine 2-[4-(1,3-benzodioxol-5-yl)-3-cyano-6-(2,4-dimethoxyphenyl)pyridin-2-yl]guanidine
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Formula C22H19N5O4
InChI InChI=1S/C22H19N5O4/c1-28-13-4-5-14(19(8-13)29-2)17-9-15(16(10-23)21(26-17)27-22(24)25)12-3-6-18-20(7-12)31-11-30-18/h3-9H,11H2,1-2H3,(H4,24,25,26,27)
InChIKey ACCVVRUJDWQUME-UHFFFAOYSA-N
Molecular Weight 417.425 g/mol
SMILES NC(=Nc1c(c(-c2cc3OCOc3cc2)cc(n1)-c1c(cc(cc1)OC)OC)C#N)N
SPLASH splash10-0f9i-5893100000-954324a30700064b5f0d
Source of Spectrum H1-53-1137-7
Wiley ID 817958