SpectraBase Spectrum ID |
BgBRn5kT47I |
Name |
trans-7-Ethoxycarbonyl-3-p-chlorophenyl-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H17ClN4O2S |
InChI |
InChI=1S/C19H17ClN4O2S/c1-2-26-18(25)16-15(12-6-4-3-5-7-12)23-24-17(21-22-19(24)27-16)13-8-10-14(20)11-9-13/h3-11,15-16,23H,2H2,1H3/t15-,16+/m1/s1 |
InChIKey |
GGUPNSMCDUGXFJ-CVEARBPZSA-N |
Molecular Weight |
400.884 g/mol |
SMILES |
N1[C@@]([C@](Sc2[n]1c(nn2)-c1ccc(cc1)Cl)(C(=O)OCC)[H])(c1ccccc1)[H] |
SPLASH |
splash10-0udi-0000900000-328d771c40303faf5eed |
Source of Spectrum |
F-67-6264-4g |
Wiley ID |
1687568 |