2-[[(4-ethoxyphenyl)methyl-methyl-amino]methyl]-4-ethyl-5-(phenylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(4-ethoxyphenyl)methyl-methyl-amino]methyl]-4-ethyl-5-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-benzyl-2-[[(4-ethoxyphenyl)methyl-methyl-amino]methyl]-4-ethyl-1,2,4-triazole-3-thione CAS Name: 2-[[(4-ethoxyphenyl)methyl-methylamino]methyl]-4-ethyl-5-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-benzyl-2-[[(4-ethoxyphenyl)methyl-methylamino]methyl]-4-ethyl-1,2,4-triazole-3-thione Traditional Name: 5-benzyl-2-[[(4-ethoxybenzyl)-methyl-amino]methyl]-4-ethyl-1,2,4-triazole-3-thione Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)OCC)CC3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)OCC)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N4OS/c1-4-25-21(15-18-9-7-6-8-10-18)23-26(22(25)28)17-24(3)16-19-11-13-20(14-12-19)27-5-2/h6-14H,4-5,15-17H2,1-3H3