3-[4-morpholin-4-yl-8-(trifluoromethyl)quinolin-3-yl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[4-morpholin-4-yl-8-(trifluoromethyl)quinolin-3-yl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[4-morpholino-8-(trifluoromethyl)-3-quinolyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[4-(4-morpholinyl)-8-(trifluoromethyl)-3-quinolinyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[4-morpholin-4-yl-8-(trifluoromethyl)quinolin-3-yl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[4-morpholino-8-(trifluoromethyl)-3-quinolyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C22H18F3N5OS MolecularWeight: 457.47143

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C3C=CC=C(C3=NC=C2C4=NNC(=S)N4C5=CC=CC=C5)C(F)(F)F

Isomeric SMILES

C1COCCN1C2=C3C=CC=C(C3=NC=C2C4=NNC(=S)N4C5=CC=CC=C5)C(F)(F)F

InChI

InChI=1S/C22H18F3N5OS/c23-22(24,25)17-8-4-7-15-18(17)26-13-16(19(15)29-9-11-31-12-10-29)20-27-28-21(32)30(20)14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,28,32)