Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LI4W8J
|
|||
| Ligand Name |
4-Oxo-N-{3-[2-(1h-1,2,4-Triazol-3-Ylsulfanyl)ethoxy]benzyl}-3,4-Dihydroquinazoline-2-Carboxamide
|
|||
| Synonyms |
CHEMBL4083954; 4-Oxo-N-{3-[2-(1h-1,2,4-Triazol-3-Ylsulfanyl)ethoxy]benzyl}-3,4-Dihydroquinazoline-2-Carboxamide; WNN; SCHEMBL688649; BDBM50233900; 4-oxo-N-[(3-{[2-(1H-1,2,4-triazol-3-ylthio)ethyl]oxy}phenyl)methyl]-3,4-dihydroquinazoline-2-carboxamide
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C20H18N6O3S
|
|||
| Canonical SMILES |
C1=CC=C2C(=C1)C(=O)NC(=N2)C(=O)NCC3=CC(=CC=C3)OCCSC4=NC=NN4
|
|||
| InChI |
1S/C20H18N6O3S/c27-18-15-6-1-2-7-16(15)24-17(25-18)19(28)21-11-13-4-3-5-14(10-13)29-8-9-30-20-22-12-23-26-20/h1-7,10,12H,8-9,11H2,(H,21,28)(H,22,23,26)(H,24,25,27)
|
|||
| InChIKey |
OXTBPBSHWBJLJN-UHFFFAOYSA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.