3-[[3-(3-methyl-4-phenylmethoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-tert-butylphenyl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C
38
H
33
N
5
O
2
S
InChI:
InChI=1/C38H33N5O2S/c1-25-21-28(17-20-32(25)45-24-26-11-7-5-8-12-26)34-29(23-42(40-34)31-13-9-6-10-14-31)22-33-36(44)43-37(46-33)39-35(41-43)27-15-18-30(19-16-27)38(2,3)4/h5-23H,24H2,1-4H3
InChIKey:
InChIKey=PBRDAYHSNMFUCJ-UHFFFAOYAH
SMILES:
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)C(C)(C)C)S3)C6=CC=CC=C6)OCC7=CC=CC=C7
Names:
3-[[3-(3-methyl-4-phenylmethoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-tert-butylphenyl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 4508701
PubChem ID 6633346
