7-(2,4-dichlorophenyl)-3-[[3-[3-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C
31
H
25
Cl
2
N
5
O
2
S
InChI:
InChI=1/C31H25Cl2N5O2S/c1-18(2)17-40-26-12-9-20(13-19(26)3)28-21(16-37(35-28)23-7-5-4-6-8-23)14-27-30(39)38-31(41-27)34-29(36-38)24-11-10-22(32)15-25(24)33/h4-16,18H,17H2,1-3H3
InChIKey:
InChIKey=MASRVASLVGQWQX-UHFFFAOYAS
SMILES:
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=C(C=C(C=C5)Cl)Cl)S3)C6=CC=CC=C6)OCC(C)C
Names:
7-(2,4-dichlorophenyl)-3-[[3-[3-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 4507825
PubChem ID 6632359
