6-(4-chlorophenyl)-3-heptanoyl-2-(1H-imidazol-2-yl)-3-oxidanyl-cyclohexa-1,5-diene-1-sulfonamide

Systemtic Name: 6-(4-chlorophenyl)-3-heptanoyl-2-(1H-imidazol-2-yl)-3-oxidanyl-cyclohexa-1,5-diene-1-sulfonamide Openeye Name: 6-(4-chlorophenyl)-3-heptanoyl-3-hydroxy-2-(1H-imidazol-2-yl)cyclohexa-1,5-diene-1-sulfonamide CAS Name: 6-(4-chlorophenyl)-3-hydroxy-2-(1H-imidazol-2-yl)-3-(1-oxoheptyl)-1-cyclohexa-1,5-dienesulfonamide IUPAC Name: 6-(4-chlorophenyl)-3-heptanoyl-3-hydroxy-2-(1H-imidazol-2-yl)cyclohexa-1,5-diene-1-sulfonamide Traditional Name: 6-(4-chlorophenyl)-3-enanthyl-3-hydroxy-2-(1H-imidazol-2-yl)cyclohexa-1,5-diene-1-sulfonamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1(CC=C(C(=C1C2=NC=CN2)S(=O)(=O)N)C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCCCCCC(=O)C1(CC=C(C(=C1C2=NC=CN2)S(=O)(=O)N)C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C22H26ClN3O4S/c1-2-3-4-5-6-18(27)22(28)12-11-17(15-7-9-16(23)10-8-15)20(31(24,29)30)19(22)21-25-13-14-26-21/h7-11,13-14,28H,2-6,12H2,1H3,(H,25,26)(H2,24,29,30)