1-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C23H16F3N5OS MolecularWeight: 467.46625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NNC(=S)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NNC(=S)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C23H16F3N5OS/c24-23(25,26)15-4-3-5-16(12-15)28-22(33)31-30-21(32)18-13-20(14-8-10-27-11-9-14)29-19-7-2-1-6-17(18)19/h1-13H,(H,30,32)(H2,28,31,33)