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

Systemtic Name: 1-naphthalen-1-yl-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Openeye Name: 1-(1-naphthyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea CAS Name: 1-(1-naphthalenyl)-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea IUPAC Name: 1-naphthalen-1-yl-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Traditional Name: 1-[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]-3-(1-naphthyl)thiourea Formula: C21H14F3N3OS MolecularWeight: 413.41557

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

InChI

InChI=1S/C21H14F3N3OS/c22-21(23,24)16-11-19(28)26-18-9-8-13(10-15(16)18)25-20(29)27-17-7-3-5-12-4-1-2-6-14(12)17/h1-11H,(H,26,28)(H2,25,27,29)