N-(2-methylbut-3-yn-2-ylcarbamothioyl)-2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propanamide

Systemtic Name: N-(2-methylbut-3-yn-2-ylcarbamothioyl)-2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propanamide Openeye Name: N-(1,1-dimethylprop-2-ynylcarbamothioyl)-2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propanamide CAS Name: N-[(2-methylbut-3-yn-2-ylamino)-sulfanylidenemethyl]-2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propanamide IUPAC Name: N-(2-methylbut-3-yn-2-ylcarbamothioyl)-2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propanamide Traditional Name: N-(1,1-dimethylprop-2-ynylthiocarbamoyl)-2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propionamide Formula: C22H21F3N2O3S MolecularWeight: 450.47395

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=S)NC(C)(C)C#C)OC1=CC=C(C=C1)OC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC(=S)NC(C)(C)C#C)OC1=CC=C(C=C1)OC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C22H21F3N2O3S/c1-5-21(3,4)27-20(31)26-19(28)14(2)29-16-10-12-18(13-11-16)30-17-8-6-15(7-9-17)22(23,24)25/h1,6-14H,2-4H3,(H2,26,27,28,31)