3-[[3-(4-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/c1-2-16-39-24-14-10-20(11-15-24)27-30-29-34(32-27)28(36)25(40-29)17-21-18-33(22-6-4-3-5-7-22)31-26(21)19-8-12-23(13-9-19)35(37)38/h3-15,17-18H,2,16H2,1H3
InChIKey:
InChIKey=SCFLAUZUVBMDDZ-UHFFFAOYAB
SMILES:
CCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)[N+](=O)[O-])C6=CC=CC=C6)SC3=N2
Names:
3-[[3-(4-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 4503486
PubChem ID 6627433
