3-[[3-(4-ethoxy-3-nitro-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
N
6
O
5
S
InChI:
InChI=1/C31H26N6O5S/c1-3-16-42-24-13-10-20(11-14-24)29-32-31-36(34-29)30(38)27(43-31)18-22-19-35(23-8-6-5-7-9-23)33-28(22)21-12-15-26(41-4-2)25(17-21)37(39)40/h5-15,17-19H,3-4,16H2,1-2H3
InChIKey:
InChIKey=KWOXKKOCWPUXDZ-UHFFFAOYAM
SMILES:
CCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=C(C=C5)OCC)[N+](=O)[O-])C6=CC=CC=C6)SC3=N2
Names:
3-[[3-(4-ethoxy-3-nitro-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 4504725
PubChem ID 6628808
