5-[1-[(4-chlorophenyl)methyl]-2-oxidanylidene-pyridin-3-yl]-4-ethyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[1-[(4-chlorophenyl)methyl]-2-oxidanylidene-pyridin-3-yl]-4-ethyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[1-[(4-chlorophenyl)methyl]-2-oxo-3-pyridyl]-4-ethyl-1,2,4-triazole-3-thiolate CAS Name: 5-[1-[(4-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-4-ethyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[1-[(4-chlorophenyl)methyl]-2-oxopyridin-3-yl]-4-ethyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[1-(4-chlorobenzyl)-2-keto-3-pyridyl]-4-ethyl-1,2,4-triazole-3-thiolate Formula: C16H14ClN4OS- MolecularWeight: 345.82656

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1[S-])C2=CC=CN(C2=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1[S-])C2=CC=CN(C2=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H15ClN4OS/c1-2-21-14(18-19-16(21)23)13-4-3-9-20(15(13)22)10-11-5-7-12(17)8-6-11/h3-9H,2,10H2,1H3,(H,19,23)/p-1