4-(butylamino)-3-morpholin-4-ylcarbonyl-5-phenoxy-benzenesulfonamide

Systemtic Name: 4-(butylamino)-3-morpholin-4-ylcarbonyl-5-phenoxy-benzenesulfonamide Openeye Name: 4-(butylamino)-3-(morpholine-4-carbonyl)-5-phenoxy-benzenesulfonamide CAS Name: 4-(butylamino)-3-[4-morpholinyl(oxo)methyl]-5-phenoxybenzenesulfonamide IUPAC Name: 4-(butylamino)-3-(morpholine-4-carbonyl)-5-phenoxybenzenesulfonamide Traditional Name: 4-(butylamino)-3-(morpholine-4-carbonyl)-5-phenoxy-benzenesulfonamide Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1C(=O)N2CCOCC2)S(=O)(=O)N)OC3=CC=CC=C3

Isomeric SMILES

CCCCNC1=C(C=C(C=C1C(=O)N2CCOCC2)S(=O)(=O)N)OC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O5S/c1-2-3-9-23-20-18(21(25)24-10-12-28-13-11-24)14-17(30(22,26)27)15-19(20)29-16-7-5-4-6-8-16/h4-8,14-15,23H,2-3,9-13H2,1H3,(H2,22,26,27)