prop-2-enyl (8Z)-2-(4-methoxyphenyl)-4-methyl-9-oxo-8-[[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]methylidene]-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Molecular Formula:
C
37
H
32
N
4
O
5
S
InChI:
InChI=1/C37H32N4O5S/c1-5-20-45-30-18-12-25(13-19-30)33-27(23-40(39-33)28-10-8-7-9-11-28)22-31-35(42)41-34(26-14-16-29(44-4)17-15-26)32(36(43)46-21-6-2)24(3)38-37(41)47-31/h5-19,22-23,34H,1-2,20-21H2,3-4H3/b31-22-
InChIKey:
InChIKey=XXUKWIYDEQOSJU-VAMRJTSQBO
SMILES:
CC1=C(C(N2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OCC=C)C5=CC=CC=C5)SC2=N1)C6=CC=C(C=C6)OC)C(=O)OCC=C
Names:
prop-2-enyl (8Z)-2-(4-methoxyphenyl)-4-methyl-9-oxo-8-[[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]methylidene]-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Registries:
PubChem CID 6296160
PubChem ID 11592283