(E,4S,5R)-4-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)-5-oxidanyl-dec-2-enamide

Systemtic Name: (E,4S,5R)-4-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)-5-oxidanyl-dec-2-enamide Openeye Name: (E,4S,5R)-5-hydroxy-N-isobutyl-4-(p-tolylsulfonyl)dec-2-enamide CAS Name: (E,4S,5R)-5-hydroxy-4-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)-2-decenamide IUPAC Name: (E,4S,5R)-5-hydroxy-4-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)dec-2-enamide Traditional Name: (E,4S,5R)-5-hydroxy-N-isobutyl-4-tosyl-dec-2-enamide Formula: C21H33NO4S MolecularWeight: 395.55602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C=CC(=O)NCC(C)C)S(=O)(=O)C1=CC=C(C=C1)C)O

Isomeric SMILES

CCCCC[C@H]([C@H](/C=C/C(=O)NCC(C)C)S(=O)(=O)C1=CC=C(C=C1)C)O

InChI

InChI=1S/C21H33NO4S/c1-5-6-7-8-19(23)20(13-14-21(24)22-15-16(2)3)27(25,26)18-11-9-17(4)10-12-18/h9-14,16,19-20,23H,5-8,15H2,1-4H3,(H,22,24)/b14-13+/t19-,20+/m1/s1