1-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methyl]-3-(2-phenylphenyl)thiourea

Systemtic Name: 1-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methyl]-3-(2-phenylphenyl)thiourea Openeye Name: 1-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-3-(2-phenylphenyl)thiourea CAS Name: 1-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-3-(2-phenylphenyl)thiourea IUPAC Name: 1-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-3-(2-phenylphenyl)thiourea Traditional Name: 1-[3-fluoro-5-(trifluoromethyl)benzyl]-3-(2-phenylphenyl)thiourea Formula: C21H16F4N2S MolecularWeight: 404.423753

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2NC(=S)NCC3=CC(=CC(=C3)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2NC(=S)NCC3=CC(=CC(=C3)F)C(F)(F)F

InChI

InChI=1S/C21H16F4N2S/c22-17-11-14(10-16(12-17)21(23,24)25)13-26-20(28)27-19-9-5-4-8-18(19)15-6-2-1-3-7-15/h1-12H,13H2,(H2,26,27,28)