4-heptoxy-2-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: 4-heptoxy-2-(trifluoromethyl)benzenecarbothioamide Openeye Name: 4-heptoxy-2-(trifluoromethyl)benzenecarbothioamide CAS Name: 4-heptoxy-2-(trifluoromethyl)benzenecarbothioamide IUPAC Name: 4-heptoxy-2-(trifluoromethyl)benzenecarbothioamide Traditional Name: 4-heptoxy-2-(trifluoromethyl)thiobenzamide Formula: C15H20F3NOS MolecularWeight: 319.38561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC(=C(C=C1)C(=S)N)C(F)(F)F

Isomeric SMILES

CCCCCCCOC1=CC(=C(C=C1)C(=S)N)C(F)(F)F

InChI

InChI=1S/C15H20F3NOS/c1-2-3-4-5-6-9-20-11-7-8-12(14(19)21)13(10-11)15(16,17)18/h7-8,10H,2-6,9H2,1H3,(H2,19,21)