| SpectraBase Spectrum ID |
qNG4tocnf4 |
| Name |
2-Phenyl-5-(ethoxycarbonyl)-7-(phenylamino)thiadiazaolo[4,5-d][1,3]diazepine |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H18N4O2S |
| InChI |
InChI=1S/C21H18N4O2S/c1-2-27-20(26)16-13-17-18(24-19(28-17)14-9-5-3-6-10-14)25-21(23-16)22-15-11-7-4-8-12-15/h3-13H,2H2,1H3,(H2,22,23,25) |
| InChIKey |
KCYFRTFBBUMRDU-UHFFFAOYSA-N |
| Molecular Weight |
390.461 g/mol |
| SMILES |
N1C(=Cc2sc(nc2N=C1Nc1ccccc1)-c1ccccc1)C(=O)OCC |
| SPLASH |
splash10-0uxu-0729000000-ea82b20817c0bf19d1e4 |
| Source of Spectrum |
J-58-5268-10 |
| Synonyms |
2-Phenyl-5-phenylamino-6H-1-thia-3,4,6-triaza-azulene-7-carboxylic acid ethyl ester |
| Wiley ID |
1364759 |
![2-Phenyl-5-(ethoxycarbonyl)-7-(phenylamino)thiadiazaolo[4,5-d][1,3]diazepine](/api/spectrum/qNG4tocnf4/structure.png?h=300&w=458 "2-Phenyl-5-(ethoxycarbonyl)-7-(phenylamino)thiadiazaolo[4,5-d][1,3]diazepine")
