5-(furan-2-yl)-2-[(4-oxidanylpiperidin-1-yl)methyl]-4-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(furan-2-yl)-2-[(4-oxidanylpiperidin-1-yl)methyl]-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 5-(2-furyl)-2-[(4-hydroxy-1-piperidyl)methyl]-4-phenyl-1,2,4-triazole-3-thione CAS Name: 5-(2-furanyl)-2-[(4-hydroxy-1-piperidinyl)methyl]-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 5-(furan-2-yl)-2-[(4-hydroxypiperidin-1-yl)methyl]-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 5-(2-furyl)-2-[(4-hydroxypiperidino)methyl]-4-phenyl-1,2,4-triazole-3-thione Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)CN2C(=S)N(C(=N2)C3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1O)CN2C(=S)N(C(=N2)C3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C18H20N4O2S/c23-15-8-10-20(11-9-15)13-21-18(25)22(14-5-2-1-3-6-14)17(19-21)16-7-4-12-24-16/h1-7,12,15,23H,8-11,13H2