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6-[5-(7-CYANOPYRAZOLO-[1,5-A]-PYRIMIDIN-6-YL)-3,4-DIMETHYLTHIENO-[2,3-B]-THIOPHEN-2-YL]-2-PHENYL-PYRAZOLO-[1,5-A]-PYRIMIDINE-7-CARBONITRILE

View entire compound with spectra: 1 NMR

6-[5-(7-CYANOPYRAZOLO-[1,5-A]-PYRIMIDIN-6-YL)-3,4-DIMETHYLTHIENO-[2,3-B]-THIOPHEN-2-YL]-2-PHENYL-PYRAZOLO-[1,5-A]-PYRIMIDINE-7-CARBONITRILE
SpectraBase Compound ID 6egH6rLZF4B
InChI InChI=1S/C34H20N8S2/c1-19-29-20(2)33(31-24(16-36)18-42-28(38-31)14-26(40-42)22-11-7-4-8-12-22)44-34(29)43-32(19)30-23(15-35)17-41-27(37-30)13-25(39-41)21-9-5-3-6-10-21/h3-14,17-18H,1-2H3
InChIKey YCIWOLMNHYXOAH-UHFFFAOYSA-N
Mol Weight 604.7 g/mol
Molecular Formula C34H20N8S2
Exact Mass 604.125235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ti0Y7FCYKY
Name 6-[5-(7-CYANOPYRAZOLO-[1,5-A]-PYRIMIDIN-6-YL)-3,4-DIMETHYLTHIENO-[2,3-B]-THIOPHEN-2-YL]-2-PHENYL-PYRAZOLO-[1,5-A]-PYRIMIDINE-7-CARBONITRILE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H20N8S2
InChI InChI=1S/C34H20N8S2/c1-19-29-20(2)33(31-24(16-36)18-42-28(38-31)14-26(40-42)22-11-7-4-8-12-22)44-34(29)43-32(19)30-23(15-35)17-41-27(37-30)13-25(39-41)21-9-5-3-6-10-21/h3-14,17-18H,1-2H3
InChIKey YCIWOLMNHYXOAH-UHFFFAOYSA-N
Literature Reference Author Y.N.MABKHOOT
Literature Reference Citation MOLECULES,14,1904(2009)
Literature Reference DOI 10.3390/molecules14051904
Molecular Weight 604.706 g/mol
Sample ID 69493
Solvent DMSO-D6