1-(3-cyanophenyl)-3-[[4-(trifluoromethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(3-cyanophenyl)-3-[[4-(trifluoromethyl)phenyl]methyl]thiourea Openeye Name: 1-(3-cyanophenyl)-3-[[4-(trifluoromethyl)phenyl]methyl]thiourea CAS Name: 1-(3-cyanophenyl)-3-[[4-(trifluoromethyl)phenyl]methyl]thiourea IUPAC Name: 1-(3-cyanophenyl)-3-[[4-(trifluoromethyl)phenyl]methyl]thiourea Traditional Name: 1-(3-cyanophenyl)-3-[4-(trifluoromethyl)benzyl]thiourea Formula: C16H12F3N3S MolecularWeight: 335.34679

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)NCC2=CC=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)NCC2=CC=C(C=C2)C(F)(F)F)C#N

InChI

InChI=1S/C16H12F3N3S/c17-16(18,19)13-6-4-11(5-7-13)10-21-15(23)22-14-3-1-2-12(8-14)9-20/h1-8H,10H2,(H2,21,22,23)