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

Systemtic Name: 2-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-4-ethyl-5-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-benzyl-2-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-4-ethyl-1,2,4-triazole-3-thione CAS Name: 2-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-4-ethyl-5-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-benzyl-2-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-4-ethyl-1,2,4-triazole-3-thione Traditional Name: 5-benzyl-2-[[(4-ethoxy-3-methoxy-benzyl)-methyl-amino]methyl]-4-ethyl-1,2,4-triazole-3-thione Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O2S/c1-5-26-22(15-18-10-8-7-9-11-18)24-27(23(26)30)17-25(3)16-19-12-13-20(29-6-2)21(14-19)28-4/h7-14H,5-6,15-17H2,1-4H3