4-tert-butyl-N-[3-[2-[(4-fluorophenyl)-methylsulfonyl-amino]butanoylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[2-[(4-fluorophenyl)-methylsulfonyl-amino]butanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[2-(4-fluoro-N-methylsulfonyl-anilino)butanoylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-(4-fluoro-N-methylsulfonylanilino)-1-oxobutyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[2-(4-fluoro-N-methylsulfonylanilino)butanoylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[2-(4-fluoro-N-mesyl-anilino)butanoylamino]phenyl]benzamide Formula: C28H32FN3O4S MolecularWeight: 525.634783

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)N(C3=CC=C(C=C3)F)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)N(C3=CC=C(C=C3)F)S(=O)(=O)C

InChI

InChI=1S/C28H32FN3O4S/c1-6-25(32(37(5,35)36)24-16-14-21(29)15-17-24)27(34)31-23-9-7-8-22(18-23)30-26(33)19-10-12-20(13-11-19)28(2,3)4/h7-18,25H,6H2,1-5H3,(H,30,33)(H,31,34)