3-[[3-(3-nitrophenyl)-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
29
H
22
N
6
O
4
S
InChI:
InChI=1/C29H22N6O4S/c1-2-15-39-24-13-11-19(12-14-24)27-30-29-34(32-27)28(36)25(40-29)17-21-18-33(22-8-4-3-5-9-22)31-26(21)20-7-6-10-23(16-20)35(37)38/h3-14,16-18H,2,15H2,1H3
InChIKey:
InChIKey=VQTSVONZWZEQCJ-UHFFFAOYAC
SMILES:
CCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=CC=C5)[N+](=O)[O-])C6=CC=CC=C6)SC3=N2
Names:
3-[[3-(3-nitrophenyl)-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 4504228
PubChem ID 6628244
