1-(4-cyanophenyl)-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea

Systemtic Name: 1-(4-cyanophenyl)-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Openeye Name: 1-(4-cyanophenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea CAS Name: 1-(4-cyanophenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea IUPAC Name: 1-(4-cyanophenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Traditional Name: 1-(4-cyanophenyl)-3-[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Formula: C18H11F3N4OS MolecularWeight: 388.36635

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F

InChI

InChI=1S/C18H11F3N4OS/c19-18(20,21)14-8-16(26)25-15-6-5-12(7-13(14)15)24-17(27)23-11-3-1-10(9-22)2-4-11/h1-8H,(H,25,26)(H2,23,24,27)