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

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Openeye Name: 1-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]-3-(p-tolylmethyl)thiourea CAS Name: 1-[(4-methylphenyl)methyl]-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea IUPAC Name: 1-[(4-methylphenyl)methyl]-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Traditional Name: 1-[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]-3-(4-methylbenzyl)thiourea Formula: C19H16F3N3OS MolecularWeight: 391.41005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F

InChI

InChI=1S/C19H16F3N3OS/c1-11-2-4-12(5-3-11)10-23-18(27)24-13-6-7-16-14(8-13)15(19(20,21)22)9-17(26)25-16/h2-9H,10H2,1H3,(H,25,26)(H2,23,24,27)