prop-2-enyl (8Z)-2-(4-acetyloxy-3-methoxy-phenyl)-4-methyl-9-oxo-8-[[1-phenyl-3-[4-(1-piperidylsulfonyl)phenyl]pyrazol-4-yl]methylidene]-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Molecular Formula:
C41H39N5O8S2
InChI: InChI=1/C41H39N5O8S2/c1-5-22-53-40(49)36-26(2)42-41-46(38(36)29-16-19-33(54-27(3)47)34(23-29)52-4)39(48)35(55-41)24-30-25-45(31-12-8-6-9-13-31)43-37(30)28-14-17-32(18-15-28)56(50,51)44-20-10-7-11-21-44/h5-6,8-9,12-19,23-25,38H,1,7,10-11,20-22H2,2-4H3/b35-24-
InChIKey: InChIKey=XYBSZOXRBMGWMN-BGDIREAQBM
SMILES: CC1=C(C(N2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)C6=CC=CC=C6)SC2=N1)C7=CC(=C(C=C7)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-(1-piperidylsulfonyl)phenyl]pyrazol-4-yl]methylidene]-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Registries:
PubChem CID 6293853
PubChem ID 11591430
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