| SpectraBase Spectrum ID |
PNw8jexJJF |
| Name |
2-Amino-6-(5-imino-4-(4-methoxyphenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl)-4-phenylnicotinonitrile |
| Appearance |
Brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H16N6OS |
| InChI |
InChI=1S/C21H16N6OS/c1-28-15-9-7-14(8-10-15)27-21(24)29-20(26-27)18-11-16(13-5-3-2-4-6-13)17(12-22)19(23)25-18/h2-11,24H,1H3,(H2,23,25) |
| InChIKey |
GUBAFGJOPCGBNI-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3088 |
| Molecular Weight |
400.460 g/mol |
| SMILES |
Nc1c(c(cc(C2=NN(C(S2)=N)c2ccc(cc2)OC)n1)-c1ccccc1)C#N |
| SPLASH |
splash10-0ufr-6972200000-5faaa4fdf6ed52baf584 |
| Source of Spectrum |
Y-55-534-4f |
| Wiley ID |
1879034 |
