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

Systemtic Name: N-[2-(butylamino)-5-morpholin-4-ylsulfonyl-phenyl]-3-fluoranyl-benzamide Openeye Name: N-[2-(butylamino)-5-morpholinosulfonyl-phenyl]-3-fluoro-benzamide CAS Name: N-[2-(butylamino)-5-(4-morpholinylsulfonyl)phenyl]-3-fluorobenzamide IUPAC Name: N-[2-(butylamino)-5-morpholin-4-ylsulfonylphenyl]-3-fluorobenzamide Traditional Name: N-[2-(butylamino)-5-morpholinosulfonyl-phenyl]-3-fluoro-benzamide Formula: C21H26FN3O4S MolecularWeight: 435.512243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26FN3O4S/c1-2-3-9-23-19-8-7-18(30(27,28)25-10-12-29-13-11-25)15-20(19)24-21(26)16-5-4-6-17(22)14-16/h4-8,14-15,23H,2-3,9-13H2,1H3,(H,24,26)