2-fluoranyl-2-methyl-5-(2-oxidanyl-4-phenyl-butyl)-N'-(thiophen-2-ylmethyl)hexanediamide

Systemtic Name: 2-fluoranyl-2-methyl-5-(2-oxidanyl-4-phenyl-butyl)-N'-(thiophen-2-ylmethyl)hexanediamide Openeye Name: 2-fluoro-5-(2-hydroxy-4-phenyl-butyl)-2-methyl-N'-(2-thienylmethyl)hexanediamide CAS Name: 2-fluoro-5-(2-hydroxy-4-phenylbutyl)-2-methyl-N'-(thiophen-2-ylmethyl)hexanediamide IUPAC Name: 2-fluoro-5-(2-hydroxy-4-phenylbutyl)-2-methyl-N'-(thiophen-2-ylmethyl)hexanediamide Traditional Name: 2-fluoro-5-(2-hydroxy-4-phenyl-butyl)-2-methyl-N'-(2-thenyl)adipamide Formula: C22H29FN2O3S MolecularWeight: 420.540663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CC(CCC1=CC=CC=C1)O)C(=O)NCC2=CC=CS2)(C(=O)N)F

Isomeric SMILES

CC(CCC(CC(CCC1=CC=CC=C1)O)C(=O)NCC2=CC=CS2)(C(=O)N)F

InChI

InChI=1S/C22H29FN2O3S/c1-22(23,21(24)28)12-11-17(20(27)25-15-19-8-5-13-29-19)14-18(26)10-9-16-6-3-2-4-7-16/h2-8,13,17-18,26H,9-12,14-15H2,1H3,(H2,24,28)(H,25,27)