3-[(4-hydroxyphenyl)methyl]-4-(4-piperidin-1-ylsulfonylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4-hydroxyphenyl)methyl]-4-(4-piperidin-1-ylsulfonylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-hydroxyphenyl)methyl]-4-[4-(1-piperidylsulfonyl)phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-hydroxyphenyl)methyl]-4-[4-(1-piperidinylsulfonyl)phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-hydroxyphenyl)methyl]-4-(4-piperidin-1-ylsulfonylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-hydroxybenzyl)-4-(4-piperidinosulfonylphenyl)-1H-1,2,4-triazole-5-thione Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C(=NNC3=S)CC4=CC=C(C=C4)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C(=NNC3=S)CC4=CC=C(C=C4)O

InChI

InChI=1S/C20H22N4O3S2/c25-17-8-4-15(5-9-17)14-19-21-22-20(28)24(19)16-6-10-18(11-7-16)29(26,27)23-12-2-1-3-13-23/h4-11,25H,1-3,12-14H2,(H,22,28)