1-[4-chloranyl-2-(trifluoromethyl)phenyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[4-chloranyl-2-(trifluoromethyl)phenyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[4-chloro-2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[4-chloro-2-(trifluoromethyl)phenyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[4-chloro-2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-benzyl-3-[4-chloro-2-(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=C(C=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

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

InChI

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