| SpectraBase Spectrum ID |
BEnNzeKNzYT |
| Name |
6-(2-Ethoxycarbonylvinyl)-5-[(4-methoxyphenylamino)piperidin-1-yl-methyleneamino]-3,4-diphenylthieno[2,3-C]pyridazine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
617.246061178 u |
| Formula |
C36H35N5O3S |
| InChI |
InChI=1S/C36H35N5O3S/c1-3-44-30(42)22-21-29-34(38-36(41-23-11-6-12-24-41)37-27-17-19-28(43-2)20-18-27)32-31(25-13-7-4-8-14-25)33(39-40-35(32)45-29)26-15-9-5-10-16-26/h4-5,7-10,13-22H,3,6,11-12,23-24H2,1-2H3,(H,37,38)/b22-21- |
| InChIKey |
QIULFKDJOHIMKZ-DQRAZIAOSA-N |
| Molecular Weight |
617.768 g/mol |
| SMILES |
C=12C(\N=C\(N3CCCCC3)NC3=CC=C(C=C3)OC)=C(\C=C/C(=O)OCC)SC2=NN=C(C1C=1C=CC=CC1)C=1C=CC=CC1 |
![6-(2-Ethoxycarbonylvinyl)-5-[(4-methoxyphenylamino)piperidin-1-yl-methyleneamino]-3,4-diphenylthieno[2,3-c]pyridazine](/api/spectrum/BEnNzeKNzYT/structure.png?h=300&w=458 "6-(2-Ethoxycarbonylvinyl)-5-[(4-methoxyphenylamino)piperidin-1-yl-methyleneamino]-3,4-diphenylthieno[2,3-c]pyridazine")
