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

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-3-[[2-(trifluoromethyloxy)phenyl]methyl]thiourea Openeye Name: 1-(4-bromo-3-methyl-phenyl)-3-[[2-(trifluoromethoxy)phenyl]methyl]thiourea CAS Name: 1-(4-bromo-3-methylphenyl)-3-[[2-(trifluoromethoxy)phenyl]methyl]thiourea IUPAC Name: 1-(4-bromo-3-methylphenyl)-3-[[2-(trifluoromethoxy)phenyl]methyl]thiourea Traditional Name: 1-(4-bromo-3-methyl-phenyl)-3-[2-(trifluoromethoxy)benzyl]thiourea Formula: C16H14BrF3N2OS MolecularWeight: 419.25937

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)NCC2=CC=CC=C2OC(F)(F)F)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)NCC2=CC=CC=C2OC(F)(F)F)Br

InChI

InChI=1S/C16H14BrF3N2OS/c1-10-8-12(6-7-13(10)17)22-15(24)21-9-11-4-2-3-5-14(11)23-16(18,19)20/h2-8H,9H2,1H3,(H2,21,22,24)