N-[2-(butylamino)-5-morpholin-4-ylsulfonyl-phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-(butylamino)-5-morpholin-4-ylsulfonyl-phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-(butylamino)-5-morpholinosulfonyl-phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[2-(butylamino)-5-(4-morpholinylsulfonyl)phenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[2-(butylamino)-5-morpholin-4-ylsulfonylphenyl]-4-fluorobenzenesulfonamide Traditional Name: N-[2-(butylamino)-5-morpholinosulfonyl-phenyl]-4-fluoro-benzenesulfonamide Formula: C20H26FN3O5S2 MolecularWeight: 471.565943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H26FN3O5S2/c1-2-3-10-22-19-9-8-18(31(27,28)24-11-13-29-14-12-24)15-20(19)23-30(25,26)17-6-4-16(21)5-7-17/h4-9,15,22-23H,2-3,10-14H2,1H3