N-[2-(butylamino)-5-morpholin-4-ylsulfonyl-phenyl]-3-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-(butylamino)-5-morpholin-4-ylsulfonyl-phenyl]-3-fluoranyl-benzenesulfonamide Openeye Name: N-[2-(butylamino)-5-morpholinosulfonyl-phenyl]-3-fluoro-benzenesulfonamide CAS Name: N-[2-(butylamino)-5-(4-morpholinylsulfonyl)phenyl]-3-fluorobenzenesulfonamide IUPAC Name: N-[2-(butylamino)-5-morpholin-4-ylsulfonylphenyl]-3-fluorobenzenesulfonamide Traditional Name: N-[2-(butylamino)-5-morpholinosulfonyl-phenyl]-3-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=CC(=C3)F

Isomeric SMILES

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

InChI

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