4-[[5-(2-fluorophenyl)furan-2-yl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[[5-(2-fluorophenyl)furan-2-yl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[[5-(2-fluorophenyl)-2-furyl]methylamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[[5-(2-fluorophenyl)-2-furanyl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[[5-(2-fluorophenyl)furan-2-yl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[[5-(2-fluorophenyl)-2-furyl]methylamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C18H14FN5OS MolecularWeight: 367.400063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(O2)CNN3C(=NNC3=S)C4=CC=NC=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(O2)CNN3C(=NNC3=S)C4=CC=NC=C4)F

InChI

InChI=1S/C18H14FN5OS/c19-15-4-2-1-3-14(15)16-6-5-13(25-16)11-21-24-17(22-23-18(24)26)12-7-9-20-10-8-12/h1-10,21H,11H2,(H,23,26)