Systematic / IUPAC Name: [4-(5-Phenylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-thiophen-2-ylmethanone
ID: Reference8435
Other Names:
Methanone, [hexahydro-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)-1H-1,4-diazepin-1-yl]-2-thienyl-;
[4-(5-Phenylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-thiophen-2-ylmethanone
Formula: C22H20N4OS2
[4-(5-Phenylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](2-thienyl)methanone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 110 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 12/11/2018 8:44:20 AM |
InChI | InChI=1S/C22H20N4OS2/c27-22(18-8-4-13-28-18)26-10-5-9-25(11-12-26)20-19-17(16-6-2-1-3-7-16)14-29-21(19)24-15-23-20/h1-4,6-8,13-15H,5,9-12H2 |
InChI Key | UYBXSKMNTSZFBK-UHFFFAOYSA-N |
Canonical SMILES | C1CN(CCN(C1)C(=O)C2=CC=CS2)C3=C4C(=CSC4=NC=N3)C5=CC=CC=C5 |
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Other Names |
Methanone, [hexahydro-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)-1H-1,4-diazepin-1-yl]-2-thienyl-; [4-(5-Phenylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-thiophen-2-ylmethanone |
ChemSpider | 2075181 |
ChEMBL | CHEMBL1457735 |
PubChem | 2796307 |