3-benzyl-8-[[1-phenyl-3-(2,4,6-trimethylphenyl)pyrazol-4-yl]methylidene]-7-thia-1,2,5-triazabicyclo[4.3.0]nona-2,5-diene-4,9-dione
Molecular Formula:
C
31
H
25
N
5
O
2
S
InChI:
InChI=1/C31H25N5O2S/c1-19-14-20(2)27(21(3)15-19)28-23(18-35(34-28)24-12-8-5-9-13-24)17-26-30(38)36-31(39-26)32-29(37)25(33-36)16-22-10-6-4-7-11-22/h4-15,17-18H,16H2,1-3H3
InChIKey:
InChIKey=PBEHQPFSNAXPHY-UHFFFAOYAU
SMILES:
CC1=CC(=C(C(=C1)C)C2=NN(C=C2C=C3C(=O)N4C(=NC(=O)C(=N4)CC5=CC=CC=C5)S3)C6=CC=CC=C6)C
Names:
3-benzyl-8-[[1-phenyl-3-(2,4,6-trimethylphenyl)pyrazol-4-yl]methylidene]-7-thia-1,2,5-triazabicyclo[4.3.0]nona-2,5-diene-4,9-dione
Registries:
PubChem CID 4502248
PubChem ID 6626072