4-[(Z)-(4-acetyloxy-3,5-dimethoxy-phenyl)methylideneamino]-5-pyridin-4-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(Z)-(4-acetyloxy-3,5-dimethoxy-phenyl)methylideneamino]-5-pyridin-4-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[(Z)-(4-acetoxy-3,5-dimethoxy-phenyl)methyleneamino]-5-(4-pyridyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[(Z)-(4-acetyloxy-3,5-dimethoxyphenyl)methylideneamino]-5-pyridin-4-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(Z)-(4-acetyloxy-3,5-dimethoxyphenyl)methylideneamino]-5-pyridin-4-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[(Z)-(4-acetoxy-3,5-dimethoxy-benzylidene)amino]-5-(4-pyridyl)-1,2,4-triazole-3-thiolate Formula: C18H16N5O4S- MolecularWeight: 398.41574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1OC)C=NN2C(=NN=C2[S-])C3=CC=NC=C3)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1OC)/C=N\N2C(=NN=C2[S-])C3=CC=NC=C3)OC

InChI

InChI=1S/C18H17N5O4S/c1-11(24)27-16-14(25-2)8-12(9-15(16)26-3)10-20-23-17(21-22-18(23)28)13-4-6-19-7-5-13/h4-10H,1-3H3,(H,22,28)/p-1/b20-10-