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

Systemtic Name: 2-[[(2-ethyl-1-benzofuran-3-yl)methyl-methyl-amino]methyl]-5-methyl-4-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-2-[[(2-ethylbenzofuran-3-yl)methyl-methyl-amino]methyl]-5-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[(2-ethyl-3-benzofuranyl)methyl-methylamino]methyl]-5-methyl-4-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-2-[[(2-ethyl-1-benzofuran-3-yl)methyl-methylamino]methyl]-5-methyl-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-2-[[(2-ethylbenzofuran-3-yl)methyl-methyl-amino]methyl]-5-methyl-1,2,4-triazole-3-thione Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)CN(C)CN3C(=S)N(C(=N3)C)CC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)CN(C)CN3C(=S)N(C(=N3)C)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4OS/c1-4-21-20(19-12-8-9-13-22(19)28-21)15-25(3)16-27-23(29)26(17(2)24-27)14-18-10-6-5-7-11-18/h5-13H,4,14-16H2,1-3H3