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

Systemtic Name: 4-(3-oxidanylpropoxy)-2-(trifluoromethyl)benzenecarbothioamide Openeye Name: 4-(3-hydroxypropoxy)-2-(trifluoromethyl)benzenecarbothioamide CAS Name: 4-(3-hydroxypropoxy)-2-(trifluoromethyl)benzenecarbothioamide IUPAC Name: 4-(3-hydroxypropoxy)-2-(trifluoromethyl)benzenecarbothioamide Traditional Name: 4-(3-hydroxypropoxy)-2-(trifluoromethyl)thiobenzamide Formula: C11H12F3NO2S MolecularWeight: 279.27869

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCCCO)C(F)(F)F)C(=S)N

Isomeric SMILES

C1=CC(=C(C=C1OCCCO)C(F)(F)F)C(=S)N

InChI

InChI=1S/C11H12F3NO2S/c12-11(13,14)9-6-7(17-5-1-4-16)2-3-8(9)10(15)18/h2-3,6,16H,1,4-5H2,(H2,15,18)