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(E)-3-(4,6-Dimethyl-2H-pyrazolo[3,4-b]pyridin-3-ylamino)-2-(benzo[d]thiazol-2-yl) acrylonitrile
SpectraBase Compound ID 5tqSuvKgxxC
InChI InChI=1S/C18H14N6S/c1-10-7-11(2)21-17-15(10)16(23-24-17)20-9-12(8-19)18-22-13-5-3-4-6-14(13)25-18/h3-7,9H,1-2H3,(H2,20,21,23,24)/b12-9+
InChIKey RACPCXORPMWNFO-FMIVXFBMSA-N
Mol Weight 346.41 g/mol
Molecular Formula C18H14N6S
Exact Mass 346.100066 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hOZyJt5y0a
Name (E)-3-(4,6-Dimethyl-2H-pyrazolo[3,4-b]pyridin-3-ylamino)-2-(benzo[d]thiazol-2-yl) acrylonitrile
Alternate Name(s) (E)-2-(benzo[d]thiazol-2-yl)-3-((4,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-yl)amino)acrylonitrile (E)-2-(1,3-benzothiazol-2-yl)-3-[(4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)amino]-2-propenenitrile (E)-2-(1,3-benzothiazol-2-yl)-3-[(4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)amino]prop-2-enenitrile
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Formula C18H14N6S
InChI InChI=1S/C18H14N6S/c1-10-7-11(2)21-17-15(10)16(23-24-17)20-9-12(8-19)18-22-13-5-3-4-6-14(13)25-18/h3-7,9H,1-2H3,(H2,20,21,23,24)/b12-9+
InChIKey RACPCXORPMWNFO-FMIVXFBMSA-N
Literature Reference DOI 10.1002/ardp.201100171
Molecular Weight 346.412 g/mol
SMILES [nH]1c(N\C=C\(c2sc3c(n2)cccc3)C#N)c2c(C)cc(nc2n1)C
SPLASH splash10-000i-0912000000-d27dd011a6e37b693b9b
Source of Spectrum APC-345-160-26
Wiley ID 1769290