1-(4-butyl-2-methyl-phenyl)-3-[[2-(trifluoromethyloxy)phenyl]methyl]thiourea

Systemtic Name: 1-(4-butyl-2-methyl-phenyl)-3-[[2-(trifluoromethyloxy)phenyl]methyl]thiourea Openeye Name: 1-(4-butyl-2-methyl-phenyl)-3-[[2-(trifluoromethoxy)phenyl]methyl]thiourea CAS Name: 1-(4-butyl-2-methylphenyl)-3-[[2-(trifluoromethoxy)phenyl]methyl]thiourea IUPAC Name: 1-(4-butyl-2-methylphenyl)-3-[[2-(trifluoromethoxy)phenyl]methyl]thiourea Traditional Name: 1-(4-butyl-2-methyl-phenyl)-3-[2-(trifluoromethoxy)benzyl]thiourea Formula: C20H23F3N2OS MolecularWeight: 396.46963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=S)NCC2=CC=CC=C2OC(F)(F)F)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=S)NCC2=CC=CC=C2OC(F)(F)F)C

InChI

InChI=1S/C20H23F3N2OS/c1-3-4-7-15-10-11-17(14(2)12-15)25-19(27)24-13-16-8-5-6-9-18(16)26-20(21,22)23/h5-6,8-12H,3-4,7,13H2,1-2H3,(H2,24,25,27)