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

Systemtic Name: 5-methyl-4-(2-methylphenyl)-2-[[(3R)-3-oxidanylpiperidin-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 2-[[(3R)-3-hydroxy-1-piperidyl]methyl]-5-methyl-4-(o-tolyl)-1,2,4-triazole-3-thione CAS Name: 2-[[(3R)-3-hydroxy-1-piperidinyl]methyl]-5-methyl-4-(2-methylphenyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[[(3R)-3-hydroxypiperidin-1-yl]methyl]-5-methyl-4-(2-methylphenyl)-1,2,4-triazole-3-thione Traditional Name: 2-[[(3R)-3-hydroxypiperidino]methyl]-5-methyl-4-(o-tolyl)-1,2,4-triazole-3-thione Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN(C2=S)CN3CCCC(C3)O)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN(C2=S)CN3CCC[C@H](C3)O)C

InChI

InChI=1S/C16H22N4OS/c1-12-6-3-4-8-15(12)20-13(2)17-19(16(20)22)11-18-9-5-7-14(21)10-18/h3-4,6,8,14,21H,5,7,9-11H2,1-2H3/t14-/m1/s1