2-(5-methyl-2-propan-2-yl-phenoxy)-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(5-methyl-2-propan-2-yl-phenoxy)-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(5-methyl-2-propan-2-ylphenoxy)-N-[[2-(1-piperidinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(5-methyl-2-propan-2-ylphenoxy)-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[[2-piperidino-5-(trifluoromethyl)phenyl]thiocarbamoyl]acetamide Formula: C25H30F3N3O2S MolecularWeight: 493.58481

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3

InChI

InChI=1S/C25H30F3N3O2S/c1-16(2)19-9-7-17(3)13-22(19)33-15-23(32)30-24(34)29-20-14-18(25(26,27)28)8-10-21(20)31-11-5-4-6-12-31/h7-10,13-14,16H,4-6,11-12,15H2,1-3H3,(H2,29,30,32,34)