4-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-quinolin-2-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-quinolin-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-3-(2-quinolyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-3-(2-quinolinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-3-quinolin-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-3-(2-quinolyl)-1H-1,2,4-triazole-5-thione Formula: C18H10ClF3N4S MolecularWeight: 406.81201

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C3=NNC(=S)N3C4=C(C=CC(=C4)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C3=NNC(=S)N3C4=C(C=CC(=C4)C(F)(F)F)Cl

InChI

InChI=1S/C18H10ClF3N4S/c19-12-7-6-11(18(20,21)22)9-15(12)26-16(24-25-17(26)27)14-8-5-10-3-1-2-4-13(10)23-14/h1-9H,(H,25,27)