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

Systemtic Name: 1-(4-methoxyphenyl)-3-[2-[[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]thiourea Openeye Name: 1-(4-methoxyphenyl)-3-[2-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]thiourea CAS Name: 1-(4-methoxyphenyl)-3-[2-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-[2-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]thiourea Traditional Name: 1-[2-[[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]-3-(4-methoxyphenyl)thiourea Formula: C25H20F3N3O2S MolecularWeight: 483.50541

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2CC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2CC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

InChI

InChI=1S/C25H20F3N3O2S/c1-33-18-9-7-17(8-10-18)29-24(34)31-21-5-3-2-4-16(21)12-15-6-11-22-19(13-15)20(25(26,27)28)14-23(32)30-22/h2-11,13-14H,12H2,1H3,(H,30,32)(H2,29,31,34)