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

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Openeye Name: 1-(2,4-dichlorophenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea CAS Name: 1-(2,4-dichlorophenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea IUPAC Name: 1-(2,4-dichlorophenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Traditional Name: 1-(2,4-dichlorophenyl)-3-[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Formula: C17H10Cl2F3N3OS MolecularWeight: 432.24701

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=S)NC3=C(C=C(C=C3)Cl)Cl)C(=CC(=O)N2)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1NC(=S)NC3=C(C=C(C=C3)Cl)Cl)C(=CC(=O)N2)C(F)(F)F

InChI

InChI=1S/C17H10Cl2F3N3OS/c18-8-1-3-14(12(19)5-8)25-16(27)23-9-2-4-13-10(6-9)11(17(20,21)22)7-15(26)24-13/h1-7H,(H,24,26)(H2,23,25,27)