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

Systemtic Name: 4-[(2S)-2-[[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[(2S)-2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]chroman-6-yl]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[(2S)-2-[[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]methyl]-3,4-dihydro-2H-1-benzopyran-6-yl]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(2S)-2-[[(2-hydroxy-2-pyridin-3-ylethyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[(2S)-2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]chroman-6-yl]-N-(2-pyrimidyl)benzenesulfonamide Formula: C27H27N5O4S MolecularWeight: 517.59938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1CC2=C(C=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)O[C@@H]1CNCC(C5=CN=CC=C5)O

InChI

InChI=1S/C27H27N5O4S/c33-25(22-3-1-12-28-16-22)18-29-17-23-8-4-21-15-20(7-11-26(21)36-23)19-5-9-24(10-6-19)37(34,35)32-27-30-13-2-14-31-27/h1-3,5-7,9-16,23,25,29,33H,4,8,17-18H2,(H,30,31,32)/t23-,25?/m0/s1