prop-2-enyl (8Z)-2-(4-acetyloxyphenyl)-4-methyl-8-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-9-oxo-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Molecular Formula:
C
36
H
30
N
4
O
5
S
InChI:
InChI=1/C36H30N4O5S/c1-5-19-44-35(43)31-23(3)37-36-40(33(31)26-15-17-29(18-16-26)45-24(4)41)34(42)30(46-36)20-27-21-39(28-9-7-6-8-10-28)38-32(27)25-13-11-22(2)12-14-25/h5-18,20-21,33H,1,19H2,2-4H3/b30-20-
InChIKey:
InChIKey=OBKWBKOIFPPKHM-COEJQBHMBD
SMILES:
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC=C)C5=CC=C(C=C5)OC(=O)C)C6=CC=CC=C6
Names:
prop-2-enyl (8Z)-2-(4-acetyloxyphenyl)-4-methyl-8-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-9-oxo-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Registries:
PubChem CID 6281197
PubChem ID 11586930