6-(4-chlorophenyl)-4-(hydroxymethyl)-5-imidazol-1-yl-4-oxidanyl-cyclohexa-1,5-diene-1-sulfonamide

Systemtic Name: 6-(4-chlorophenyl)-4-(hydroxymethyl)-5-imidazol-1-yl-4-oxidanyl-cyclohexa-1,5-diene-1-sulfonamide Openeye Name: 6-(4-chlorophenyl)-4-hydroxy-4-(hydroxymethyl)-5-imidazol-1-yl-cyclohexa-1,5-diene-1-sulfonamide CAS Name: 6-(4-chlorophenyl)-4-hydroxy-4-(hydroxymethyl)-5-(1-imidazolyl)-1-cyclohexa-1,5-dienesulfonamide IUPAC Name: 6-(4-chlorophenyl)-4-hydroxy-4-(hydroxymethyl)-5-imidazol-1-ylcyclohexa-1,5-diene-1-sulfonamide Traditional Name: 6-(4-chlorophenyl)-4-hydroxy-5-imidazol-1-yl-4-methylol-cyclohexa-1,5-diene-1-sulfonamide Formula: C16H16ClN3O4S MolecularWeight: 381.83394

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(=C(C1(CO)O)N2C=CN=C2)C3=CC=C(C=C3)Cl)S(=O)(=O)N

Isomeric SMILES

C1C=C(C(=C(C1(CO)O)N2C=CN=C2)C3=CC=C(C=C3)Cl)S(=O)(=O)N

InChI

InChI=1S/C16H16ClN3O4S/c17-12-3-1-11(2-4-12)14-13(25(18,23)24)5-6-16(22,9-21)15(14)20-8-7-19-10-20/h1-5,7-8,10,21-22H,6,9H2,(H2,18,23,24)