SpectraBase Spectrum ID |
9mSOHyeLpC5 |
Name |
1,3-Diphenyl-4-(3,4,5-trimethoxy-phenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H25N3O4S |
InChI |
InChI=1S/C27H25N3O4S/c1-32-20-14-18(15-21(33-2)25(20)34-3)26-23-24(17-10-6-4-7-11-17)29-30(19-12-8-5-9-13-19)27(23)28-22(31)16-35-26/h4-15,26H,16H2,1-3H3,(H,28,31) |
InChIKey |
GQUWQXDAHYJUGG-UHFFFAOYSA-N |
Molecular Weight |
487.574 g/mol |
SMILES |
N1C(CSC(c2c1[n](nc2-c1ccccc1)-c1ccccc1)c1cc(OC)c(c(c1)OC)OC)=O |
SPLASH |
splash10-00di-5956300000-ff2d8329f6447a166158 |
Synonyms |
1,3-Diphenyl-4-(3,4,5-trimethoxyphenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one |
Wiley ID |
1442983 |