N-[4-[[4-(4-fluorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanylmethyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(4-fluorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanylmethyl]phenyl]ethanamide Openeye Name: N-[4-[[3-(4-fluorophenyl)-1-(imidazol-1-ylmethyl)propyl]sulfanylmethyl]phenyl]acetamide CAS Name: N-[4-[[[4-(4-fluorophenyl)-1-(1-imidazolyl)butan-2-yl]thio]methyl]phenyl]acetamide IUPAC Name: N-[4-[[4-(4-fluorophenyl)-1-imidazol-1-ylbutan-2-yl]sulfanylmethyl]phenyl]acetamide Traditional Name: N-[4-[[[3-(4-fluorophenyl)-1-(imidazol-1-ylmethyl)propyl]thio]methyl]phenyl]acetamide Formula: C22H24FN3OS MolecularWeight: 397.508863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CSC(CCC2=CC=C(C=C2)F)CN3C=CN=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CSC(CCC2=CC=C(C=C2)F)CN3C=CN=C3

InChI

InChI=1S/C22H24FN3OS/c1-17(27)25-21-9-4-19(5-10-21)15-28-22(14-26-13-12-24-16-26)11-6-18-2-7-20(23)8-3-18/h2-5,7-10,12-13,16,22H,6,11,14-15H2,1H3,(H,25,27)