SpectraBase Spectrum ID |
7rHRfhvcPiz |
Name |
Methanone, [5-amino-7-thia-1,9-diazatetracyclo[9.2.2.0(2,10).0(4,8)]pentadeca-2,4(8),5,9-tetraen-6-yl](3,4-dimethoxyphenyl)- |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H21N3O3S |
InChI |
InChI=1S/C21H21N3O3S/c1-26-15-4-3-12(9-16(15)27-2)19(25)20-17(22)13-10-14-18(23-21(13)28-20)11-5-7-24(14)8-6-11/h3-4,9-11H,5-8,22H2,1-2H3 |
InChIKey |
XWDMLVAJGZYRDE-UHFFFAOYSA-N |
Molecular Weight |
395.477 g/mol |
SMILES |
Nc1c(sc2nc3c(cc12)N1CCC3CC1)C(=O)c1ccc(c(c1)OC)OC |
SPLASH |
splash10-0007-2419000000-bcaba2eebdc23bd14f1d |
Source of Spectrum |
IY-1-4502-7 |
Wiley ID |
1653010 |