4-[3-fluoranyl-5-[[4-(2-methylimidazol-1-yl)phenyl]methoxy]phenyl]oxane-4-carbothioamide

Systemtic Name: 4-[3-fluoranyl-5-[[4-(2-methylimidazol-1-yl)phenyl]methoxy]phenyl]oxane-4-carbothioamide Openeye Name: 4-[3-fluoro-5-[[4-(2-methylimidazol-1-yl)phenyl]methoxy]phenyl]tetrahydropyran-4-carbothioamide CAS Name: 4-[3-fluoro-5-[[4-(2-methyl-1-imidazolyl)phenyl]methoxy]phenyl]-4-oxanecarbothioamide IUPAC Name: 4-[3-fluoro-5-[[4-(2-methylimidazol-1-yl)phenyl]methoxy]phenyl]oxane-4-carbothioamide Traditional Name: 4-[3-fluoro-5-[4-(2-methylimidazol-1-yl)benzyl]oxy-phenyl]tetrahydropyran-4-carbothioamide Formula: C23H24FN3O2S MolecularWeight: 425.518963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)COC3=CC(=CC(=C3)C4(CCOCC4)C(=S)N)F

Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)COC3=CC(=CC(=C3)C4(CCOCC4)C(=S)N)F

InChI

InChI=1S/C23H24FN3O2S/c1-16-26-8-9-27(16)20-4-2-17(3-5-20)15-29-21-13-18(12-19(24)14-21)23(22(25)30)6-10-28-11-7-23/h2-5,8-9,12-14H,6-7,10-11,15H2,1H3,(H2,25,30)