(3Z)-3-[[3-(4-ethylsulfanylphenyl)-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
33
H
31
N
5
O
2
S
2
InChI:
InChI=1/C33H31N5O2S2/c1-3-5-9-20-40-27-16-12-24(13-17-27)31-34-33-38(36-31)32(39)29(42-33)21-25-22-37(26-10-7-6-8-11-26)35-30(25)23-14-18-28(19-15-23)41-4-2/h6-8,10-19,21-22H,3-5,9,20H2,1-2H3/b29-21-
InChIKey:
InChIKey=RHQFEFOUCONNKH-ANYBSYGZBU
SMILES:
CCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)SCC)C6=CC=CC=C6)SC3=N2
Names:
(3Z)-3-[[3-(4-ethylsulfanylphenyl)-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 6398305
PubChem ID 11611681
