N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-5-quinolin-3-yl-2,3-dihydro-1-benzofuran-7-sulfonamide

Systemtic Name: N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-5-quinolin-3-yl-2,3-dihydro-1-benzofuran-7-sulfonamide Openeye Name: N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-5-(3-quinolyl)-2,3-dihydrobenzofuran-7-sulfonamide CAS Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-5-(3-quinolinyl)-2,3-dihydrobenzofuran-7-sulfonamide IUPAC Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-5-quinolin-3-yl-2,3-dihydro-1-benzofuran-7-sulfonamide Traditional Name: N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-5-(3-quinolyl)coumaran-7-sulfonamide Formula: C28H25N3O4S MolecularWeight: 499.5808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2S(=O)(=O)NC(CC3=CNC4=CC=CC=C43)CO)C5=CC6=CC=CC=C6N=C5

Isomeric SMILES

C1COC2=C1C=C(C=C2S(=O)(=O)N[C@H](CC3=CNC4=CC=CC=C43)CO)C5=CC6=CC=CC=C6N=C5

InChI

InChI=1S/C28H25N3O4S/c32-17-23(13-22-16-30-26-8-4-2-6-24(22)26)31-36(33,34)27-14-20(12-19-9-10-35-28(19)27)21-11-18-5-1-3-7-25(18)29-15-21/h1-8,11-12,14-16,23,30-32H,9-10,13,17H2/t23-/m1/s1