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

Systemtic Name: 5-[1-[(3,4-dichlorophenyl)methyl]-2-oxidanylidene-pyridin-3-yl]-4-methyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridyl]-4-methyl-1,2,4-triazole-3-thiolate CAS Name: 5-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]-4-methyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[1-[(3,4-dichlorophenyl)methyl]-2-oxopyridin-3-yl]-4-methyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[1-(3,4-dichlorobenzyl)-2-keto-3-pyridyl]-4-methyl-1,2,4-triazole-3-thiolate Formula: C15H11Cl2N4OS- MolecularWeight: 366.24504

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1[S-])C2=CC=CN(C2=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CN1C(=NN=C1[S-])C2=CC=CN(C2=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C15H12Cl2N4OS/c1-20-13(18-19-15(20)23)10-3-2-6-21(14(10)22)8-9-4-5-11(16)12(17)7-9/h2-7H,8H2,1H3,(H,19,23)/p-1