5-[(4-fluoranylphenoxy)methyl]-2-[(4-oxidanylpiperidin-1-yl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 5-[(4-fluoranylphenoxy)methyl]-2-[(4-oxidanylpiperidin-1-yl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-[(4-fluorophenoxy)methyl]-2-[(4-hydroxy-1-piperidyl)methyl]-1,2,4-triazole-3-thione CAS Name: 5-[(4-fluorophenoxy)methyl]-2-[(4-hydroxy-1-piperidinyl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 5-[(4-fluorophenoxy)methyl]-2-[(4-hydroxypiperidin-1-yl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-[(4-fluorophenoxy)methyl]-2-[(4-hydroxypiperidino)methyl]-1,2,4-triazole-3-thione Formula: C18H23FN4O2S MolecularWeight: 378.464223

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN(C1=S)CN2CCC(CC2)O)COC3=CC=C(C=C3)F

Isomeric SMILES

C=CCN1C(=NN(C1=S)CN2CCC(CC2)O)COC3=CC=C(C=C3)F

InChI

InChI=1S/C18H23FN4O2S/c1-2-9-22-17(12-25-16-5-3-14(19)4-6-16)20-23(18(22)26)13-21-10-7-15(24)8-11-21/h2-6,15,24H,1,7-13H2