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

Systemtic Name: 3-[2-[[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-N-pyridin-3-yl-benzenesulfonamide Openeye Name: 3-[2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]chroman-6-yl]-N-(3-pyridyl)benzenesulfonamide CAS Name: 3-[2-[[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]methyl]-3,4-dihydro-2H-1-benzopyran-6-yl]-N-(3-pyridinyl)benzenesulfonamide IUPAC Name: 3-[2-[[(2-hydroxy-2-pyridin-3-ylethyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-N-pyridin-3-ylbenzenesulfonamide Traditional Name: 3-[2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]chroman-6-yl]-N-(3-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=CN=CC=C4)OC1CNCC(C5=CN=CC=C5)O

Isomeric SMILES

C1CC2=C(C=CC(=C2)C3=CC(=CC=C3)S(=O)(=O)NC4=CN=CC=C4)OC1CNCC(C5=CN=CC=C5)O

InChI

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