Chemical Component Summary

NameN-[(R)-1-benzofuran-2-yl(phenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
IdentifiersN-[(R)-1-benzofuran-2-yl(phenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
FormulaC24 H21 N O5 S
Molecular Weight435.492
TypeNON-POLYMER
Isomeric SMILESc1ccc(cc1)[C@H](c2cc3ccccc3o2)NS(=O)(=O)c4ccc5c(c4)OCCCO5
InChIInChI=1S/C24H21NO5S/c26-31(27,19-11-12-21-22(16-19)29-14-6-13-28-21)25-24(17-7-2-1-3-8-17)23-15-18-9-4-5-10-20(18)30-23/h1-5,7-12,15-16,24-25H,6,13-14H2/t24-/m1/s1
InChIKeyKMUUQMAWJDDNPP-XMMPIXPASA-N

Chemical Details

Formal Charge0
Atom Count52
Chiral Atom Count1
Bond Count56
Aromatic Bond Count22

Related Resource References

Resource NameReference
Pharos CHEMBL3746716
PubChem 25956468
ChEMBL CHEMBL3746716