SpectraBase Spectrum ID |
1Rx4DZ6XpY1 |
Name |
N-[4-(2-Thienyl)-6-(trifluoromethyl)-2-pyrimidinyl]-1,3-benzoxazol-2-amine |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
362.044916588 u |
Formula |
C16H9F3N4OS |
InChI |
InChI=1S/C16H9F3N4OS/c17-16(18,19)13-8-10(12-6-3-7-25-12)20-14(22-13)23-15-21-9-4-1-2-5-11(9)24-15/h1-8H,(H,20,21,22,23) |
InChIKey |
AYULLHRYBLVTJR-UHFFFAOYSA-N |
Molecular Weight |
362.330 g/mol |
SMILES |
N(C=1N=C(C(F)(F)F)C=C(N1)C=1SC=CC1)C1=NC=2C=CC=CC2O1 |