1-quinolin-8-yl-3-[3-(trifluoromethylsulfanyl)phenyl]urea

Systemtic Name: 1-quinolin-8-yl-3-[3-(trifluoromethylsulfanyl)phenyl]urea Openeye Name: 1-(8-quinolyl)-3-[3-(trifluoromethylsulfanyl)phenyl]urea CAS Name: 1-(8-quinolinyl)-3-[3-(trifluoromethylthio)phenyl]urea IUPAC Name: 1-quinolin-8-yl-3-[3-(trifluoromethylsulfanyl)phenyl]urea Traditional Name: 1-(8-quinolyl)-3-[3-(trifluoromethylthio)phenyl]urea Formula: C17H12F3N3OS MolecularWeight: 363.35689

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC(=O)NC3=CC(=CC=C3)SC(F)(F)F)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)NC(=O)NC3=CC(=CC=C3)SC(F)(F)F)N=CC=C2

InChI

InChI=1S/C17H12F3N3OS/c18-17(19,20)25-13-7-2-6-12(10-13)22-16(24)23-14-8-1-4-11-5-3-9-21-15(11)14/h1-10H,(H2,22,23,24)