4-[[2-[(11-cyano-9-azabicyclo[6.4.0]dodeca-8,10,12-trien-10-yl)sulfanyl]acetyl]amino]benzoic acid

Molecular Formula: C21H21N3O3S


InChI: InChI=1/C21H21N3O3S/c22-12-16-11-15-5-3-1-2-4-6-18(15)24-20(16)28-13-19(25)23-17-9-7-14(8-10-17)21(26)27/h7-11H,1-6,13H2,(H,23,25)(H,26,27)/f/h23,26H

InChIKey: InChIKey=FIPIWZMGTPREBF-DXAUXPAJCO
SMILES: C1CCCC2=C(CC1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)C(=O)O)C#N

Names:
    4-[[2-[(11-cyano-9-azabicyclo[6.4.0]dodeca-8,10,12-trien-10-yl)sulfanyl]acetyl]amino]benzoic acid

Registries:
    PubChem CID 3617473
    PubChem ID 9766557