| SpectraBase Spectrum ID |
8z2mJGnQKKk |
| Name |
6,6'-(1,4-phenylene)bis(4-amino-2-(benzylthio)pyrimidine-5-carbonitrile) |
| Appearance |
Yellow powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H22N8S2 |
| InChI |
InChI=1S/C30H22N8S2/c31-15-23-25(35-29(37-27(23)33)39-17-19-7-3-1-4-8-19)21-11-13-22(14-12-21)26-24(16-32)28(34)38-30(36-26)40-18-20-9-5-2-6-10-20/h1-14H,17-18H2,(H2,33,35,37)(H2,34,36,38) |
| InChIKey |
TVKVSUSRZMPIJO-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 8430 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.4363 |
| Molecular Weight |
558.682 g/mol |
| SMILES |
Nc1nc(nc(-c2ccc(-c3c(c(nc(n3)SCc3ccccc3)N)C#N)cc2)c1C#N)SCc1ccccc1 |
| SPLASH |
splash10-0006-9340100000-cfcc4c0d4115ad8047cb |
| Source of Spectrum |
Y-58-SM5-10a |
| Wiley ID |
1880881 |
