4-fluoranyl-3-(heptoxymethyl)benzenecarbothioamide

Systemtic Name: 4-fluoranyl-3-(heptoxymethyl)benzenecarbothioamide Openeye Name: 4-fluoro-3-(heptoxymethyl)benzenecarbothioamide CAS Name: 4-fluoro-3-(heptoxymethyl)benzenecarbothioamide IUPAC Name: 4-fluoro-3-(heptoxymethyl)benzenecarbothioamide Traditional Name: 4-fluoro-3-(heptoxymethyl)thiobenzamide Formula: C15H22FNOS MolecularWeight: 283.404683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCC1=C(C=CC(=C1)C(=S)N)F

Isomeric SMILES

CCCCCCCOCC1=C(C=CC(=C1)C(=S)N)F

InChI

InChI=1S/C15H22FNOS/c1-2-3-4-5-6-9-18-11-13-10-12(15(17)19)7-8-14(13)16/h7-8,10H,2-6,9,11H2,1H3,(H2,17,19)