7,9-Dimethyl-4-{[5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl]sulfanyl}pyrido[3',2' 4,5]thieno[3,2-d]pyrimidine

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Systematic / IUPAC Name: 7,9-Dimethyl-4-{[5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidine

ID: Reference4793

Other Names: 7,9-Dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl 5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl sulfide;
Pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 7,9-dimethyl-4-{[5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl]thio}-

Formula: C18H12N6OS2

Spectral Data

7,9-Dimethyl-4-{[5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl]sulfanyl}pyrido[3',2' 4,5]thieno[3,2-d]pyrimidine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 5/11/2016 1:40:22 PM
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Identificators

InChI InChI=1S/C18H12N6OS2/c1-9-7-10(2)22-16-12(9)13-14(26-16)17(21-8-20-13)27-18-24-23-15(25-18)11-3-5-19-6-4-11/h3-8H,1-2H3
InChI Key PEHWQUMDGURJNJ-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=NC2=C1C3=C(S2)C(=NC=N3)SC4=NN=C(O4)C5=CC=NC=C5)C
CAS
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Other Names 7,9-Dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl 5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl sulfide;
Pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 7,9-dimethyl-4-{[5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl]thio}-

In Other Databases

PubChem 2816090
ChemSpider 2094437