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6-(2-Methylthio-1,3,4-oxadiazol-5-yl)-4-methyl-5-(1- pyrrolyl)-2-phenylthieno[2,3-d]pyrimidine
SpectraBase Compound ID 5dyj91KP3AB
InChI InChI=1S/C20H15N5OS2/c1-12-14-15(25-10-6-7-11-25)16(18-23-24-20(26-18)27-2)28-19(14)22-17(21-12)13-8-4-3-5-9-13/h3-11H,1-2H3
InChIKey GEKSKKUDECPACA-UHFFFAOYSA-N
Mol Weight 405.49 g/mol
Molecular Formula C20H15N5OS2
Exact Mass 405.071802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cr1x5vv7Ga
Name 6-(2-Methylthio-1,3,4-oxadiazol-5-yl)-4-methyl-5-(1- pyrrolyl)-2-phenylthieno[2,3-d]pyrimidine
Alternate Name(s) 2-(4-Methyl-2-phenyl-5-(1H-pyrrol-1-yl)thieno[2,3-d]pyrimidin-6-yl)-5-(methylthio)-1,3,4-oxadiazole
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Formula C20H15N5OS2
InChI InChI=1S/C20H15N5OS2/c1-12-14-15(25-10-6-7-11-25)16(18-23-24-20(26-18)27-2)28-19(14)22-17(21-12)13-8-4-3-5-9-13/h3-11H,1-2H3
InChIKey GEKSKKUDECPACA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200900060
Molecular Weight 405.494 g/mol
SMILES c1(nc2c(c(n1)C)c(c(s2)-c1nnc(o1)SC)-[n]1cccc1)-c1ccccc1
SPLASH splash10-0a4i-0117900000-797888f82229532d3011
Source of Spectrum QA-56-414-7
Wiley ID 1791198