3-[[3-(4-ethoxy-3-fluoro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(3-methylbenzofuran-2-yl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C
31
H
22
FN
5
O
3
S
InChI:
InChI=1/C31H22FN5O3S/c1-3-39-25-14-13-19(15-23(25)32)27-20(17-36(34-27)21-9-5-4-6-10-21)16-26-30(38)37-31(41-26)33-29(35-37)28-18(2)22-11-7-8-12-24(22)40-28/h4-17H,3H2,1-2H3
InChIKey:
InChIKey=IOCBJFMOJLUASK-UHFFFAOYAM
SMILES:
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=C(C6=CC=CC=C6O5)C)S3)C7=CC=CC=C7)F
Names:
3-[[3-(4-ethoxy-3-fluoro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(3-methylbenzofuran-2-yl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 4506730
PubChem ID 6631084