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

Systemtic Name: 4-(3,4-dimethylphenyl)-2-[(4-oxidanylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione Openeye Name: 4-(3,4-dimethylphenyl)-2-[(4-hydroxy-1-piperidyl)methyl]-5-phenyl-1,2,4-triazole-3-thione CAS Name: 4-(3,4-dimethylphenyl)-2-[(4-hydroxy-1-piperidinyl)methyl]-5-phenyl-1,2,4-triazole-3-thione IUPAC Name: 4-(3,4-dimethylphenyl)-2-[(4-hydroxypiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione Traditional Name: 4-(3,4-dimethylphenyl)-2-[(4-hydroxypiperidino)methyl]-5-phenyl-1,2,4-triazole-3-thione Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NN(C2=S)CN3CCC(CC3)O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NN(C2=S)CN3CCC(CC3)O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H26N4OS/c1-16-8-9-19(14-17(16)2)26-21(18-6-4-3-5-7-18)23-25(22(26)28)15-24-12-10-20(27)11-13-24/h3-9,14,20,27H,10-13,15H2,1-2H3