[English] 日本語
Yorodumi- ChemComp-J74: 4-{2-[(6-chloro-5-nitropyrimidin-4-yl)amino]ethyl}benzenesulfonamide -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: J74 |
---|---|
Name | Name: |
-Chemical information
Composition | Formula: C12H12ClN5O4S / Number of atoms: 35 / Formula weight: 357.773 / Formal charge: 0 | ||||||
---|---|---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: J74 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3M2N | ||||||
History |
| ||||||
External links | UniChem / ChemSpider / PubChem / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
---|
-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.7.0 | |
---|
-PDB entries
Showing all 1 items
PDB-3m2n:
Crystal structure of human carbonic anhydrase isozyme II with 4-{2-[N-(6-chloro-5-nitropyrimidin-4-yl)amino]ethyl}benzenesulfonamide