3-(butoxymethyl)-4-fluoranyl-benzenecarbothioamide

Systemtic Name: 3-(butoxymethyl)-4-fluoranyl-benzenecarbothioamide Openeye Name: 3-(butoxymethyl)-4-fluoro-benzenecarbothioamide CAS Name: 3-(butoxymethyl)-4-fluorobenzenecarbothioamide IUPAC Name: 3-(butoxymethyl)-4-fluorobenzenecarbothioamide Traditional Name: 3-(butoxymethyl)-4-fluoro-thiobenzamide Formula: C12H16FNOS MolecularWeight: 241.324943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC1=C(C=CC(=C1)C(=S)N)F

Isomeric SMILES

CCCCOCC1=C(C=CC(=C1)C(=S)N)F

InChI

InChI=1S/C12H16FNOS/c1-2-3-6-15-8-10-7-9(12(14)16)4-5-11(10)13/h4-5,7H,2-3,6,8H2,1H3,(H2,14,16)