4-(1H-indol-3-yl)-2-[[6-(methylsulfonylamino)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]butanamide

Systemtic Name: 4-(1H-indol-3-yl)-2-[[6-(methylsulfonylamino)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]butanamide Openeye Name: 4-(1H-indol-3-yl)-2-[[6-(methanesulfonamido)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]butanamide CAS Name: 4-(1H-indol-3-yl)-2-[[6-(methanesulfonamido)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]butanamide IUPAC Name: 4-(1H-indol-3-yl)-2-[[6-(methanesulfonamido)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]butanamide Traditional Name: 4-(1H-indol-3-yl)-2-[[6-(methanesulfonamido)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]butyramide Formula: C22H25N3O5S MolecularWeight: 443.516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC2=C(C=C1)OCC(O2)CC(CCC3=CNC4=CC=CC=C43)C(=O)N

Isomeric SMILES

CS(=O)(=O)NC1=CC2=C(C=C1)OCC(O2)CC(CCC3=CNC4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C22H25N3O5S/c1-31(27,28)25-16-8-9-20-21(11-16)30-17(13-29-20)10-14(22(23)26)6-7-15-12-24-19-5-3-2-4-18(15)19/h2-5,8-9,11-12,14,17,24-25H,6-7,10,13H2,1H3,(H2,23,26)