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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-4-[(Z)-pyridin-4-ylmethylideneamino]-1,2,4-triazole-3-thiolate Openeye Name: 5-(3,4-dimethoxyphenyl)-4-[(Z)-4-pyridylmethyleneamino]-1,2,4-triazole-3-thiolate CAS Name: 5-(3,4-dimethoxyphenyl)-4-[(Z)-pyridin-4-ylmethylideneamino]-1,2,4-triazole-3-thiolate IUPAC Name: 5-(3,4-dimethoxyphenyl)-4-[(Z)-pyridin-4-ylmethylideneamino]-1,2,4-triazole-3-thiolate Traditional Name: 5-(3,4-dimethoxyphenyl)-4-[(Z)-4-pyridylmethyleneamino]-1,2,4-triazole-3-thiolate Formula: C16H14N5O2S- MolecularWeight: 340.37966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(N2N=CC3=CC=NC=C3)[S-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(N2/N=C\C3=CC=NC=C3)[S-])OC

InChI

InChI=1S/C16H15N5O2S/c1-22-13-4-3-12(9-14(13)23-2)15-19-20-16(24)21(15)18-10-11-5-7-17-8-6-11/h3-10H,1-2H3,(H,20,24)/p-1/b18-10-