1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(4-quinolin-4-ylsulfanylphenyl)thiourea

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(4-quinolin-4-ylsulfanylphenyl)thiourea Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(4-quinolylsulfanyl)phenyl]thiourea CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(4-quinolinylthio)phenyl]thiourea IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(4-quinolin-4-ylsulfanylphenyl)thiourea Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(4-quinolylthio)phenyl]thiourea Formula: C23H15ClF3N3S2 MolecularWeight: 489.96351

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)SC3=CC=C(C=C3)NC(=S)NC4=CC(=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)SC3=CC=C(C=C3)NC(=S)NC4=CC(=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C23H15ClF3N3S2/c24-19-10-7-15(13-18(19)23(25,26)27)30-22(31)29-14-5-8-16(9-6-14)32-21-11-12-28-20-4-2-1-3-17(20)21/h1-13H,(H2,29,30,31)