3-benzyl-8-[[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-thia-1,2,5-triazabicyclo[4.3.0]nona-2,5-diene-4,9-dione
Molecular Formula:
C
30
H
22
N
6
O
5
S
InChI:
InChI=1/C30H22N6O5S/c1-2-41-25-14-13-20(16-24(25)36(39)40)27-21(18-34(33-27)22-11-7-4-8-12-22)17-26-29(38)35-30(42-26)31-28(37)23(32-35)15-19-9-5-3-6-10-19/h3-14,16-18H,2,15H2,1H3
InChIKey:
InChIKey=JKYLDEWNUNRRQG-UHFFFAOYAK
SMILES:
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=O)C(=N4)CC5=CC=CC=C5)S3)C6=CC=CC=C6)[N+](=O)[O-]
Names:
3-benzyl-8-[[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-thia-1,2,5-triazabicyclo[4.3.0]nona-2,5-diene-4,9-dione
Registries:
PubChem CID 4504937
PubChem ID 6629051
