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

Systemtic Name: 5-(4-methoxyphenyl)-2-[[(3R)-3-oxidanylpiperidin-1-yl]methyl]-4-propan-2-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[(3R)-3-hydroxy-1-piperidyl]methyl]-4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazole-3-thione CAS Name: 2-[[(3R)-3-hydroxy-1-piperidinyl]methyl]-5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(3R)-3-hydroxypiperidin-1-yl]methyl]-5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[(3R)-3-hydroxypiperidino]methyl]-4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazole-3-thione Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN(C1=S)CN2CCCC(C2)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)N1C(=NN(C1=S)CN2CCC[C@H](C2)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H26N4O2S/c1-13(2)22-17(14-6-8-16(24-3)9-7-14)19-21(18(22)25)12-20-10-4-5-15(23)11-20/h6-9,13,15,23H,4-5,10-12H2,1-3H3/t15-/m1/s1