N-(1,3-Benzodioxol-5-ylmethyl)-6-phenylthieno[3,2-d]pyrimidin-4-amine

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Systematic / IUPAC Name: N-(1,3-Benzodioxol-5-ylmethyl)-6-phenylthieno[3,2-d]pyrimidin-4-amine

ID: Reference6465

Other Names: N-(2H-1,3-Benzodioxol-5-ylmethyl)-6-phenylthieno[3,2-d]pyrimidin-4-amine;
Thieno[3,2-d]pyrimidin-4-amine, N-(1,3-benzodioxol-5-ylmethyl)-6-phenyl-

Formula: C20H15N3O2S

Spectral Data

N-(1,3-Benzodioxol-5-ylmethyl)-6-phenylthieno[3,2-d]pyrimidin-4-amine 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/13/2017 9:47:31 AM
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Identificators

InChI InChI=1S/C20H15N3O2S/c1-2-4-14(5-3-1)18-9-15-19(26-18)20(23-11-22-15)21-10-13-6-7-16-17(8-13)25-12-24-16/h1-9,11H,10,12H2,(H,21,22,23)
InChI Key XMFKHUJYYBHBPH-UHFFFAOYSA-N
Canonical SMILES C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC4=C3SC(=C4)C5=CC=CC=C5
CAS
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Other Names N-(2H-1,3-Benzodioxol-5-ylmethyl)-6-phenylthieno[3,2-d]pyrimidin-4-amine;
Thieno[3,2-d]pyrimidin-4-amine, N-(1,3-benzodioxol-5-ylmethyl)-6-phenyl-

In Other Databases

PubChem 2809722
ChemSpider 2088143
ChEMBL CHEMBL205344