2-[[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]methyl]-N-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromene-6-sulfonamide

Systemtic Name: 2-[[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]methyl]-N-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromene-6-sulfonamide Openeye Name: 2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]-N-(4-isopropylphenyl)chromane-6-sulfonamide CAS Name: 2-[[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]methyl]-N-(4-propan-2-ylphenyl)-3,4-dihydro-2H-1-benzopyran-6-sulfonamide IUPAC Name: 2-[[(2-hydroxy-2-pyridin-3-ylethyl)amino]methyl]-N-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromene-6-sulfonamide Traditional Name: 2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]-N-p-cumenyl-chroman-6-sulfonamide Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OC(CC3)CNCC(C4=CN=CC=C4)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OC(CC3)CNCC(C4=CN=CC=C4)O

InChI

InChI=1S/C26H31N3O4S/c1-18(2)19-5-8-22(9-6-19)29-34(31,32)24-11-12-26-20(14-24)7-10-23(33-26)16-28-17-25(30)21-4-3-13-27-15-21/h3-6,8-9,11-15,18,23,25,28-30H,7,10,16-17H2,1-2H3