4-(3-methylbutoxy)-2-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: 4-(3-methylbutoxy)-2-(trifluoromethyl)benzenecarbothioamide Openeye Name: 4-isopentyloxy-2-(trifluoromethyl)benzenecarbothioamide CAS Name: 4-(3-methylbutoxy)-2-(trifluoromethyl)benzenecarbothioamide IUPAC Name: 4-(3-methylbutoxy)-2-(trifluoromethyl)benzenecarbothioamide Traditional Name: 4-isoamoxy-2-(trifluoromethyl)thiobenzamide Formula: C13H16F3NOS MolecularWeight: 291.33245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC(=C(C=C1)C(=S)N)C(F)(F)F

Isomeric SMILES

CC(C)CCOC1=CC(=C(C=C1)C(=S)N)C(F)(F)F

InChI

InChI=1S/C13H16F3NOS/c1-8(2)5-6-18-9-3-4-10(12(17)19)11(7-9)13(14,15)16/h3-4,7-8H,5-6H2,1-2H3,(H2,17,19)