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

Systemtic Name: 1-(2-methylphenyl)-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Openeye Name: 1-(o-tolyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea CAS Name: 1-(2-methylphenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Traditional Name: 1-[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]-3-(o-tolyl)thiourea Formula: C18H14F3N3OS MolecularWeight: 377.38347

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F

InChI

InChI=1S/C18H14F3N3OS/c1-10-4-2-3-5-14(10)24-17(26)22-11-6-7-15-12(8-11)13(18(19,20)21)9-16(25)23-15/h2-9H,1H3,(H,23,25)(H2,22,24,26)