ethyl 4-[8-[(3-nitrophenyl)methylidene]-9-oxo-7-thia-1,3,5-triazabicyclo[4.3.0]non-5-en-3-yl]benzoate

Molecular Formula: C21H18N4O5S


InChI: InChI=1/C21H18N4O5S/c1-2-30-20(27)15-6-8-16(9-7-15)23-12-22-21-24(13-23)19(26)18(31-21)11-14-4-3-5-17(10-14)25(28)29/h3-11H,2,12-13H2,1H3

InChIKey: InChIKey=LNSBLDRFUZADKJ-UHFFFAOYAN
SMILES: CCOC(=O)C1=CC=C(C=C1)N2CN=C3N(C2)C(=O)C(=CC4=CC(=CC=C4)[N+](=O)[O-])S3

Names:
    ethyl 4-[8-[(3-nitrophenyl)methylidene]-9-oxo-7-thia-1,3,5-triazabicyclo[4.3.0]non-5-en-3-yl]benzoate

Registries:
    PubChem CID 1415330
    PubChem ID 4781543