1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[4-chloro-3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[4-chloro-3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-benzyl-3-[4-chloro-3-(trifluoromethyl)phenyl]thiourea Formula: C15H12ClF3N2S MolecularWeight: 344.78239

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C15H12ClF3N2S/c16-13-7-6-11(8-12(13)15(17,18)19)21-14(22)20-9-10-4-2-1-3-5-10/h1-8H,9H2,(H2,20,21,22)