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

Systemtic Name: 4-(3-methylphenyl)-2-[(4-oxidanylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[(4-hydroxy-1-piperidyl)methyl]-4-(m-tolyl)-5-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[(4-hydroxy-1-piperidinyl)methyl]-4-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-hydroxypiperidin-1-yl)methyl]-4-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[(4-hydroxypiperidino)methyl]-4-(m-tolyl)-5-phenyl-1,2,4-triazole-3-thione Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4OS/c1-16-6-5-9-18(14-16)25-20(17-7-3-2-4-8-17)22-24(21(25)27)15-23-12-10-19(26)11-13-23/h2-9,14,19,26H,10-13,15H2,1H3