Chemical Component Summary

NameN-{3-[(1Z)-1-(10-methoxydibenzo[b,e]oxepin-11(6H)-ylidene)propyl]phenyl}methanesulfonamide
IdentifiersN-[3-[(1Z)-1-(10-methoxy-6H-benzo[c][1]benzoxepin-11-ylidene)propyl]phenyl]methanesulfonamide
FormulaC25 H25 N O4 S
Molecular Weight435.535
TypeNON-POLYMER
Isomeric SMILESCC/C(=C/1\c2ccccc2OCc3c1c(ccc3)OC)/c4cccc(c4)NS(=O)(=O)C
InChIInChI=1S/C25H25NO4S/c1-4-20(17-9-7-11-19(15-17)26-31(3,27)28)25-21-12-5-6-13-22(21)30-16-18-10-8-14-23(29-2)24(18)25/h5-15,26H,4,16H2,1-3H3/b25-20-
InChIKeyPHIKAOOZNGLKDI-QQTULTPQSA-N

Chemical Details

Formal Charge0
Atom Count56
Chiral Atom Count0
Bond Count59
Aromatic Bond Count18

Related Resource References

Resource NameReference
Pharos CHEMBL3120317
PubChem 72710581
ChEMBL CHEMBL3120317