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

Systemtic Name: 5-(furan-2-yl)-2-[(4-oxidanylpiperidin-1-yl)methyl]-4-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-5-(2-furyl)-2-[(4-hydroxy-1-piperidyl)methyl]-1,2,4-triazole-3-thione CAS Name: 5-(2-furanyl)-2-[(4-hydroxy-1-piperidinyl)methyl]-4-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-5-(furan-2-yl)-2-[(4-hydroxypiperidin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-5-(2-furyl)-2-[(4-hydroxypiperidino)methyl]-1,2,4-triazole-3-thione Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)CN2C(=S)N(C(=N2)C3=CC=CO3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1O)CN2C(=S)N(C(=N2)C3=CC=CO3)CC4=CC=CC=C4

InChI

InChI=1S/C19H22N4O2S/c24-16-8-10-21(11-9-16)14-23-19(26)22(13-15-5-2-1-3-6-15)18(20-23)17-7-4-12-25-17/h1-7,12,16,24H,8-11,13-14H2