(3Z)-3-[[3-(3-chloro-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-pentoxyphenyl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C
34
H
32
ClN
5
O
3
S
InChI:
InChI=1/C34H32ClN5O3S/c1-3-5-9-19-42-27-15-12-23(13-16-27)32-36-34-40(38-32)33(41)30(44-34)21-25-22-39(26-10-7-6-8-11-26)37-31(25)24-14-17-29(28(35)20-24)43-18-4-2/h6-8,10-17,20-22H,3-5,9,18-19H2,1-2H3/b30-21-
InChIKey:
InChIKey=KNIIPVNSUPNKTK-OFWBYEQRBA
SMILES:
CCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=C(C=C5)OCCC)Cl)C6=CC=CC=C6)SC3=N2
Names:
(3Z)-3-[[3-(3-chloro-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-pentoxyphenyl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 6318574
PubChem ID 11598621
