3-[[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-methylphenyl)-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
InChI:
InChI=1/C33H31N5O2S/c1-3-4-5-9-20-40-28-18-16-24(17-19-28)30-26(22-37(35-30)27-10-7-6-8-11-27)21-29-32(39)38-33(41-29)34-31(36-38)25-14-12-23(2)13-15-25/h6-8,10-19,21-22H,3-5,9,20H2,1-2H3
InChIKey:
InChIKey=BQXVHFPCKAOMJL-UHFFFAOYAX
SMILES:
CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)C)S3)C6=CC=CC=C6
Names:
3-[[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-methylphenyl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 4506951
PubChem ID 6631326
