2-(diethylaminomethyl)-4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-(diethylaminomethyl)-4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-(diethylaminomethyl)-4-(4-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-(diethylaminomethyl)-4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-(diethylaminomethyl)-4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-(diethylaminomethyl)-4-(4-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C18H20FN5S MolecularWeight: 357.448303

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CN1C(=S)N(C(=N1)C2=CC=NC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC)CN1C(=S)N(C(=N1)C2=CC=NC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN5S/c1-3-22(4-2)13-23-18(25)24(16-7-5-15(19)6-8-16)17(21-23)14-9-11-20-12-10-14/h5-12H,3-4,13H2,1-2H3