7-(7,10-dioxabicyclo[4.4.0]deca-1,3,5-trien-9-yl)-3-[[3-(3-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C
29
H
20
FN
5
O
4
S
InChI:
InChI=1/C29H20FN5O4S/c1-37-21-12-11-17(13-20(21)30)26-18(15-34(32-26)19-7-3-2-4-8-19)14-25-28(36)35-29(40-25)31-27(33-35)24-16-38-22-9-5-6-10-23(22)39-24/h2-15,24H,16H2,1H3
InChIKey:
InChIKey=GXTLJDVKOFZDGP-UHFFFAOYAJ
SMILES:
COC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5COC6=CC=CC=C6O5)S3)C7=CC=CC=C7)F
Names:
7-(7,10-dioxabicyclo[4.4.0]deca-1,3,5-trien-9-yl)-3-[[3-(3-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 4505836
PubChem ID 6630086
