| SpectraBase Spectrum ID |
B4VsQLAbbP6 |
| Name |
4-(1,3-Benzodioxol-5-yl)-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H19N3O3S |
| InChI |
InChI=1S/C25H19N3O3S/c29-21-14-32-24(17-11-12-19-20(13-17)31-15-30-19)22-23(16-7-3-1-4-8-16)27-28(25(22)26-21)18-9-5-2-6-10-18/h1-13,24H,14-15H2,(H,26,29) |
| InChIKey |
MLEOHXUMJITUDX-UHFFFAOYSA-N |
| Molecular Weight |
441.505 g/mol |
| SMILES |
N1C(CSC(c2c1[n](nc2-c1ccccc1)-c1ccccc1)c1cc2OCOc2cc1)=O |
| SPLASH |
splash10-00dl-5739300000-c8c65fcdd36c31990299 |
| Synonyms |
4-Benzo[1,3]dioxol-5-yl-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one |
| Wiley ID |
1442655 |
![4-(1,3-Benzodioxol-5-yl)-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one](/api/spectrum/B4VsQLAbbP6/structure.png?h=300&w=458 "4-(1,3-Benzodioxol-5-yl)-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one")
