1-[[2-fluoranyl-4-(trifluoromethyl)phenyl]methyl]-3-(2-methoxy-5-methyl-phenyl)thiourea

Systemtic Name: 1-[[2-fluoranyl-4-(trifluoromethyl)phenyl]methyl]-3-(2-methoxy-5-methyl-phenyl)thiourea Openeye Name: 1-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-3-(2-methoxy-5-methyl-phenyl)thiourea CAS Name: 1-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-3-(2-methoxy-5-methylphenyl)thiourea IUPAC Name: 1-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-[2-fluoro-4-(trifluoromethyl)benzyl]-3-(2-methoxy-5-methyl-phenyl)thiourea Formula: C17H16F4N2OS MolecularWeight: 372.380353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)NCC2=C(C=C(C=C2)C(F)(F)F)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)NCC2=C(C=C(C=C2)C(F)(F)F)F

InChI

InChI=1S/C17H16F4N2OS/c1-10-3-6-15(24-2)14(7-10)23-16(25)22-9-11-4-5-12(8-13(11)18)17(19,20)21/h3-8H,9H2,1-2H3,(H2,22,23,25)