3-fluoranyl-4-(heptoxymethyl)benzenecarbothioamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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