3-fluoranyl-4-(2,3,5-trimethylphenoxy)benzenecarbothioamide

Systemtic Name: 3-fluoranyl-4-(2,3,5-trimethylphenoxy)benzenecarbothioamide Openeye Name: 3-fluoro-4-(2,3,5-trimethylphenoxy)benzenecarbothioamide CAS Name: 3-fluoro-4-(2,3,5-trimethylphenoxy)benzenecarbothioamide IUPAC Name: 3-fluoro-4-(2,3,5-trimethylphenoxy)benzenecarbothioamide Traditional Name: 3-fluoro-4-(2,3,5-trimethylphenoxy)thiobenzamide Formula: C16H16FNOS MolecularWeight: 289.367743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=C(C=C(C=C2)C(=S)N)F)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=C(C=C(C=C2)C(=S)N)F)C)C

InChI

InChI=1S/C16H16FNOS/c1-9-6-10(2)11(3)15(7-9)19-14-5-4-12(16(18)20)8-13(14)17/h4-8H,1-3H3,(H2,18,20)