3-[[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-pyridin-3-yl-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one

Molecular Formula: C31H28N6O2S


InChI: InChI=1/C31H28N6O2S/c1-2-3-4-8-18-39-26-15-13-22(14-16-26)28-24(21-36(34-28)25-11-6-5-7-12-25)19-27-30(38)37-31(40-27)33-29(35-37)23-10-9-17-32-20-23/h5-7,9-17,19-21H,2-4,8,18H2,1H3

InChIKey: InChIKey=DCLUOXGAJYBCLE-UHFFFAOYAD
SMILES: CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CN=CC=C5)S3)C6=CC=CC=C6

Names:
    3-[[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-pyridin-3-yl-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one

Registries:
    PubChem CID 4506959
    PubChem ID 6631334