3-[[3-(4-ethoxy-3-fluoro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-propoxyphenyl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C
31
H
26
FN
5
O
3
S
InChI:
InChI=1/C31H26FN5O3S/c1-3-16-40-24-13-10-20(11-14-24)29-33-31-37(35-29)30(38)27(41-31)18-22-19-36(23-8-6-5-7-9-23)34-28(22)21-12-15-26(39-4-2)25(32)17-21/h5-15,17-19H,3-4,16H2,1-2H3
InChIKey:
InChIKey=CLCWHXPYDODFMO-UHFFFAOYAU
SMILES:
CCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=C(C=C5)OCC)F)C6=CC=CC=C6)SC3=N2
Names:
3-[[3-(4-ethoxy-3-fluoro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-propoxyphenyl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 4506527
PubChem ID 6630840