5-[(4-ethylphenoxy)methyl]-4-(phenylmethyl)-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-[(4-ethylphenoxy)methyl]-4-(phenylmethyl)-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-5-[(4-ethylphenoxy)methyl]-2-(1-piperidylmethyl)-1,2,4-triazole-3-thione CAS Name: 5-[(4-ethylphenoxy)methyl]-4-(phenylmethyl)-2-(1-piperidinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-5-[(4-ethylphenoxy)methyl]-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-5-[(4-ethylphenoxy)methyl]-2-(piperidinomethyl)-1,2,4-triazole-3-thione Formula: C24H30N4OS MolecularWeight: 422.5862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=NN(C(=S)N2CC3=CC=CC=C3)CN4CCCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=NN(C(=S)N2CC3=CC=CC=C3)CN4CCCCC4

InChI

InChI=1S/C24H30N4OS/c1-2-20-11-13-22(14-12-20)29-18-23-25-28(19-26-15-7-4-8-16-26)24(30)27(23)17-21-9-5-3-6-10-21/h3,5-6,9-14H,2,4,7-8,15-19H2,1H3