1-(pyridin-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(pyridin-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-pyridylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(2-pyridinylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(pyridin-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-pyridylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C14H12F3N3S MolecularWeight: 311.32539

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12F3N3S/c15-14(16,17)10-4-3-6-11(8-10)20-13(21)19-9-12-5-1-2-7-18-12/h1-8H,9H2,(H2,19,20,21)