N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-5-(4-methylphenyl)-2,3-dihydro-1-benzofuran-7-sulfonamide

Systemtic Name: N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-5-(4-methylphenyl)-2,3-dihydro-1-benzofuran-7-sulfonamide Openeye Name: N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-5-(p-tolyl)-2,3-dihydrobenzofuran-7-sulfonamide CAS Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-5-(4-methylphenyl)-2,3-dihydrobenzofuran-7-sulfonamide IUPAC Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-5-(4-methylphenyl)-2,3-dihydro-1-benzofuran-7-sulfonamide Traditional Name: N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-5-(p-tolyl)coumaran-7-sulfonamide Formula: C26H26N2O4S MolecularWeight: 462.56064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C(=C2)S(=O)(=O)NC(CC4=CNC5=CC=CC=C54)CO)OCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C(=C2)S(=O)(=O)N[C@H](CC4=CNC5=CC=CC=C54)CO)OCC3

InChI

InChI=1S/C26H26N2O4S/c1-17-6-8-18(9-7-17)20-12-19-10-11-32-26(19)25(14-20)33(30,31)28-22(16-29)13-21-15-27-24-5-3-2-4-23(21)24/h2-9,12,14-15,22,27-29H,10-11,13,16H2,1H3/t22-/m1/s1