4-[(Z)-pyridin-4-ylmethylideneamino]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(Z)-pyridin-4-ylmethylideneamino]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-[(Z)-4-pyridylmethyleneamino]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[(Z)-pyridin-4-ylmethylideneamino]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(Z)-pyridin-4-ylmethylideneamino]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-[(Z)-4-pyridylmethyleneamino]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C17H16N5O3S- MolecularWeight: 370.40564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(N2N=CC3=CC=NC=C3)[S-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(N2/N=C\C3=CC=NC=C3)[S-]

InChI

InChI=1S/C17H17N5O3S/c1-23-13-8-12(9-14(24-2)15(13)25-3)16-20-21-17(26)22(16)19-10-11-4-6-18-7-5-11/h4-10H,1-3H3,(H,21,26)/p-1/b19-10-