4-cyano-N-[3-[2-[5-[1-[3-[(4-cyanophenyl)sulfonylamino]phenyl]propyl]-6-oxidanyl-4-oxidanylidene-2-propyl-3H-pyran-2-yl]ethyl]phenyl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[3-[2-[5-[1-[3-[(4-cyanophenyl)sulfonylamino]phenyl]propyl]-6-oxidanyl-4-oxidanylidene-2-propyl-3H-pyran-2-yl]ethyl]phenyl]benzenesulfonamide Openeye Name: 4-cyano-N-[3-[2-[5-[1-[3-[(4-cyanophenyl)sulfonylamino]phenyl]propyl]-6-hydroxy-4-oxo-2-propyl-3H-pyran-2-yl]ethyl]phenyl]benzenesulfonamide CAS Name: 4-cyano-N-[3-[2-[5-[1-[3-[(4-cyanophenyl)sulfonylamino]phenyl]propyl]-6-hydroxy-4-oxo-2-propyl-3H-pyran-2-yl]ethyl]phenyl]benzenesulfonamide IUPAC Name: 4-cyano-N-[3-[2-[5-[1-[3-[(4-cyanophenyl)sulfonylamino]phenyl]propyl]-6-hydroxy-4-oxo-2-propyl-3H-pyran-2-yl]ethyl]phenyl]benzenesulfonamide Traditional Name: 4-cyano-N-[3-[2-[5-[1-[3-[(4-cyanophenyl)sulfonylamino]phenyl]propyl]-6-hydroxy-4-keto-2-propyl-3H-pyran-2-yl]ethyl]phenyl]benzenesulfonamide Formula: C39H38N4O7S2 MolecularWeight: 738.87162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(=O)C(=C(O1)O)C(CC)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)C#N)CCC4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

CCCC1(CC(=O)C(=C(O1)O)C(CC)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)C#N)CCC4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C39H38N4O7S2/c1-3-20-39(21-19-27-7-5-9-31(22-27)42-51(46,47)33-15-11-28(25-40)12-16-33)24-36(44)37(38(45)50-39)35(4-2)30-8-6-10-32(23-30)43-52(48,49)34-17-13-29(26-41)14-18-34/h5-18,22-23,35,42-43,45H,3-4,19-21,24H2,1-2H3