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

Systemtic Name: 1-(4-chlorophenyl)-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea CAS Name: 1-(4-chlorophenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Formula: C17H11ClF3N3OS MolecularWeight: 397.80195

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F)Cl

InChI

InChI=1S/C17H11ClF3N3OS/c18-9-1-3-10(4-2-9)22-16(26)23-11-5-6-14-12(7-11)13(17(19,20)21)8-15(25)24-14/h1-8H,(H,24,25)(H2,22,23,26)