4-(4-ethoxyphenyl)-2-[(4-methylpiperidin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-(4-ethoxyphenyl)-2-[(4-methylpiperidin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-(4-ethoxyphenyl)-2-[(4-methyl-1-piperidyl)methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-(4-ethoxyphenyl)-2-[(4-methyl-1-piperidinyl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-(4-ethoxyphenyl)-2-[(4-methylpiperidin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[(4-methylpiperidino)methyl]-4-p-phenetyl-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN(C2=S)CN3CCC(CC3)C)C4=CC=NC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN(C2=S)CN3CCC(CC3)C)C4=CC=NC=C4

InChI

InChI=1S/C22H27N5OS/c1-3-28-20-6-4-19(5-7-20)27-21(18-8-12-23-13-9-18)24-26(22(27)29)16-25-14-10-17(2)11-15-25/h4-9,12-13,17H,3,10-11,14-16H2,1-2H3