1-(5-chloranyl-2,4-dimethoxy-phenyl)-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea

Systemtic Name: 1-(5-chloranyl-2,4-dimethoxy-phenyl)-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Openeye Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea CAS Name: 1-(5-chloro-2,4-dimethoxyphenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea IUPAC Name: 1-(5-chloro-2,4-dimethoxyphenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Traditional Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Formula: C19H15ClF3N3O3S MolecularWeight: 457.85391

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F)Cl)OC

InChI

InChI=1S/C19H15ClF3N3O3S/c1-28-15-8-16(29-2)14(7-12(15)20)26-18(30)24-9-3-4-13-10(5-9)11(19(21,22)23)6-17(27)25-13/h3-8H,1-2H3,(H,25,27)(H2,24,26,30)