2-[(5-ethyl-2-methyl-morpholin-4-yl)methyl]-4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[(5-ethyl-2-methyl-morpholin-4-yl)methyl]-4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[(5-ethyl-2-methyl-morpholin-4-yl)methyl]-4-(4-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[(5-ethyl-2-methyl-4-morpholinyl)methyl]-4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[(5-ethyl-2-methyl-morpholino)methyl]-4-(4-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C21H24FN5OS MolecularWeight: 413.511563

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC(CN1CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CCC1COC(CN1CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C21H24FN5OS/c1-3-18-13-28-15(2)12-25(18)14-26-21(29)27(19-6-4-17(22)5-7-19)20(24-26)16-8-10-23-11-9-16/h4-11,15,18H,3,12-14H2,1-2H3