7-(4-ethoxyphenyl)-3-[[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C
34
H
33
N
5
O
3
S
InChI:
InChI=1/C34H33N5O3S/c1-3-5-6-10-21-42-29-17-13-24(14-18-29)31-26(23-38(36-31)27-11-8-7-9-12-27)22-30-33(40)39-34(43-30)35-32(37-39)25-15-19-28(20-16-25)41-4-2/h7-9,11-20,22-23H,3-6,10,21H2,1-2H3
InChIKey:
InChIKey=KMLIRLVYERRLID-UHFFFAOYAX
SMILES:
CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)OCC)S3)C6=CC=CC=C6
Names:
7-(4-ethoxyphenyl)-3-[[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 4506953
PubChem ID 6631328