4-[(E)-(4-methoxycarbonylphenyl)methylideneamino]-5-pyridin-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(E)-(4-methoxycarbonylphenyl)methylideneamino]-5-pyridin-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[(E)-(4-methoxycarbonylphenyl)methyleneamino]-5-(2-pyridyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[(E)-(4-methoxycarbonylphenyl)methylideneamino]-5-(2-pyridinyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(E)-(4-methoxycarbonylphenyl)methylideneamino]-5-pyridin-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[(E)-(4-carbomethoxybenzylidene)amino]-5-(2-pyridyl)-1,2,4-triazole-3-thiolate Formula: C16H12N5O2S- MolecularWeight: 338.36378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NN2C(=NN=C2[S-])C3=CC=CC=N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=N/N2C(=NN=C2[S-])C3=CC=CC=N3

InChI

InChI=1S/C16H13N5O2S/c1-23-15(22)12-7-5-11(6-8-12)10-18-21-14(19-20-16(21)24)13-4-2-3-9-17-13/h2-10H,1H3,(H,20,24)/p-1/b18-10+