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

Systemtic Name: 5-(4-methoxyphenyl)-2-[(3-oxidanylpiperidin-1-yl)methyl]-4-(2-propan-2-ylphenyl)-1,2,4-triazole-3-thione Openeye Name: 2-[(3-hydroxy-1-piperidyl)methyl]-4-(2-isopropylphenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thione CAS Name: 2-[(3-hydroxy-1-piperidinyl)methyl]-5-(4-methoxyphenyl)-4-(2-propan-2-ylphenyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[(3-hydroxypiperidin-1-yl)methyl]-5-(4-methoxyphenyl)-4-(2-propan-2-ylphenyl)-1,2,4-triazole-3-thione Traditional Name: 2-[(3-hydroxypiperidino)methyl]-5-(4-methoxyphenyl)-4-o-cumenyl-1,2,4-triazole-3-thione Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=NN(C2=S)CN3CCCC(C3)O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=NN(C2=S)CN3CCCC(C3)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H30N4O2S/c1-17(2)21-8-4-5-9-22(21)28-23(18-10-12-20(30-3)13-11-18)25-27(24(28)31)16-26-14-6-7-19(29)15-26/h4-5,8-13,17,19,29H,6-7,14-16H2,1-3H3