4-ethyl-2-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-ethyl-2-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-2-[[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-ethyl-2-[[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-2-[[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-2-[[4-(3-fluoro-4-methoxy-benzyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C17H24FN5OS MolecularWeight: 365.468763

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN(C1=S)CN2CCN(CC2)CC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCN1C=NN(C1=S)CN2CCN(CC2)CC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C17H24FN5OS/c1-3-22-12-19-23(17(22)25)13-21-8-6-20(7-9-21)11-14-4-5-16(24-2)15(18)10-14/h4-5,10,12H,3,6-9,11,13H2,1-2H3