1-(4-dimethylaminophenyl)-3-[[2-fluoranyl-4-(trifluoromethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(4-dimethylaminophenyl)-3-[[2-fluoranyl-4-(trifluoromethyl)phenyl]methyl]thiourea Openeye Name: 1-(4-dimethylaminophenyl)-3-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]thiourea CAS Name: 1-(4-dimethylaminophenyl)-3-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]thiourea IUPAC Name: 1-(4-dimethylaminophenyl)-3-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]thiourea Traditional Name: 1-(4-dimethylaminophenyl)-3-[2-fluoro-4-(trifluoromethyl)benzyl]thiourea Formula: C17H17F4N3S MolecularWeight: 371.395593

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=S)NCC2=C(C=C(C=C2)C(F)(F)F)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)NCC2=C(C=C(C=C2)C(F)(F)F)F

InChI

InChI=1S/C17H17F4N3S/c1-24(2)14-7-5-13(6-8-14)23-16(25)22-10-11-3-4-12(9-15(11)18)17(19,20)21/h3-9H,10H2,1-2H3,(H2,22,23,25)