N-butyl-2-[2-[(4-fluorophenyl)-methylsulfonyl-amino]butanoylamino]benzamide

Systemtic Name: N-butyl-2-[2-[(4-fluorophenyl)-methylsulfonyl-amino]butanoylamino]benzamide Openeye Name: N-butyl-2-[2-(4-fluoro-N-methylsulfonyl-anilino)butanoylamino]benzamide CAS Name: N-butyl-2-[[2-(4-fluoro-N-methylsulfonylanilino)-1-oxobutyl]amino]benzamide IUPAC Name: N-butyl-2-[2-(4-fluoro-N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: N-butyl-2-[2-(4-fluoro-N-mesyl-anilino)butanoylamino]benzamide Formula: C22H28FN3O4S MolecularWeight: 449.538823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)C(CC)N(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)C(CC)N(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C22H28FN3O4S/c1-4-6-15-24-21(27)18-9-7-8-10-19(18)25-22(28)20(5-2)26(31(3,29)30)17-13-11-16(23)12-14-17/h7-14,20H,4-6,15H2,1-3H3,(H,24,27)(H,25,28)