3-[2-[[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-N-pyridin-2-yl-benzenesulfonamide

Systemtic Name: 3-[2-[[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-N-pyridin-2-yl-benzenesulfonamide Openeye Name: 3-[2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]chroman-6-yl]-N-(2-pyridyl)benzenesulfonamide CAS Name: 3-[2-[[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]methyl]-3,4-dihydro-2H-1-benzopyran-6-yl]-N-(2-pyridinyl)benzenesulfonamide IUPAC Name: 3-[2-[[(2-hydroxy-2-pyridin-3-ylethyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-N-pyridin-2-ylbenzenesulfonamide Traditional Name: 3-[2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]chroman-6-yl]-N-(2-pyridyl)benzenesulfonamide Formula: C28H28N4O4S MolecularWeight: 516.61132

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=N4)OC1CNCC(C5=CN=CC=C5)O

Isomeric SMILES

C1CC2=C(C=CC(=C2)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=N4)OC1CNCC(C5=CN=CC=C5)O

InChI

InChI=1S/C28H28N4O4S/c33-26(23-6-4-13-29-17-23)19-30-18-24-11-9-22-15-21(10-12-27(22)36-24)20-5-3-7-25(16-20)37(34,35)32-28-8-1-2-14-31-28/h1-8,10,12-17,24,26,30,33H,9,11,18-19H2,(H,31,32)