1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(4-pyridylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(4-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(=CC(=C1)NC(=S)NCC2=CC=NC=C2)C(F)(F)F

Isomeric SMILES

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

InChI

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