5-[(4-ethoxyphenyl)methyl]-4-[(4-methylphenyl)sulfonylamino]-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(4-ethoxyphenyl)methyl]-4-[(4-methylphenyl)sulfonylamino]-1,2,4-triazole-3-thiolate Openeye Name: 5-[(4-ethoxyphenyl)methyl]-4-(p-tolylsulfonylamino)-1,2,4-triazole-3-thiolate CAS Name: 5-[(4-ethoxyphenyl)methyl]-4-[(4-methylphenyl)sulfonylamino]-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(4-ethoxyphenyl)methyl]-4-[(4-methylphenyl)sulfonylamino]-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-ethoxybenzyl)-4-(tosylamino)-1,2,4-triazole-3-thiolate Formula: C18H19N4O3S2- MolecularWeight: 403.49846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=NN=C(N2NS(=O)(=O)C3=CC=C(C=C3)C)[S-]

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=NN=C(N2NS(=O)(=O)C3=CC=C(C=C3)C)[S-]

InChI

InChI=1S/C18H20N4O3S2/c1-3-25-15-8-6-14(7-9-15)12-17-19-20-18(26)22(17)21-27(23,24)16-10-4-13(2)5-11-16/h4-11,21H,3,12H2,1-2H3,(H,20,26)/p-1