prop-2-enyl (8Z)-2-(4-acetyloxy-3-methoxy-phenyl)-4-methyl-9-oxo-8-[[1-phenyl-3-(4-propan-2-yloxyphenyl)pyrazol-4-yl]methylidene]-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Molecular Formula:
C
39
H
36
N
4
O
7
S
InChI:
InChI=1/C39H36N4O7S/c1-7-19-48-38(46)34-24(4)40-39-43(36(34)27-15-18-31(50-25(5)44)32(20-27)47-6)37(45)33(51-39)21-28-22-42(29-11-9-8-10-12-29)41-35(28)26-13-16-30(17-14-26)49-23(2)3/h7-18,20-23,36H,1,19H2,2-6H3/b33-21-
InChIKey:
InChIKey=RMOKPJANSYVNLI-HWIUFGAZBU
SMILES:
CC1=C(C(N2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OC(C)C)C5=CC=CC=C5)SC2=N1)C6=CC(=C(C=C6)OC(=O)C)OC)C(=O)OCC=C
Names:
prop-2-enyl (8Z)-2-(4-acetyloxy-3-methoxy-phenyl)-4-methyl-9-oxo-8-[[1-phenyl-3-(4-propan-2-yloxyphenyl)pyrazol-4-yl]methylidene]-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Registries:
PubChem CID 6297608
PubChem ID 11592803