N-[2-butyl-3-[4-[3-(butylamino)propoxy]phenyl]carbonyl-1-benzofuran-5-yl]methanesulfonamide

Systemtic Name: N-[2-butyl-3-[4-[3-(butylamino)propoxy]phenyl]carbonyl-1-benzofuran-5-yl]methanesulfonamide Openeye Name: N-[2-butyl-3-[4-[3-(butylamino)propoxy]benzoyl]benzofuran-5-yl]methanesulfonamide CAS Name: N-[2-butyl-3-[[4-[3-(butylamino)propoxy]phenyl]-oxomethyl]-5-benzofuranyl]methanesulfonamide IUPAC Name: N-[2-butyl-3-[4-[3-(butylamino)propoxy]benzoyl]-1-benzofuran-5-yl]methanesulfonamide Traditional Name: N-[2-butyl-3-[4-[3-(butylamino)propoxy]benzoyl]benzofuran-5-yl]methanesulfonamide Formula: C27H36N2O5S MolecularWeight: 500.65014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C)C(=O)C3=CC=C(C=C3)OCCCNCCCC

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C)C(=O)C3=CC=C(C=C3)OCCCNCCCC

InChI

InChI=1S/C27H36N2O5S/c1-4-6-9-25-26(23-19-21(29-35(3,31)32)12-15-24(23)34-25)27(30)20-10-13-22(14-11-20)33-18-8-17-28-16-7-5-2/h10-15,19,28-29H,4-9,16-18H2,1-3H3