5-(5-cyclopropyl-1H-pyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(5-cyclopropyl-1H-pyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(5-cyclopropyl-1H-pyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(5-cyclopropyl-1H-pyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(5-cyclopropyl-1H-pyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(5-cyclopropyl-1H-pyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C16H16N5O2S- MolecularWeight: 342.39554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=NN=C2[S-])C3=NNC(=C3)C4CC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=NN=C2[S-])C3=NNC(=C3)C4CC4

InChI

InChI=1S/C16H17N5O2S/c1-22-10-5-6-14(23-2)13(7-10)21-15(19-20-16(21)24)12-8-11(17-18-12)9-3-4-9/h5-9H,3-4H2,1-2H3,(H,17,18)(H,20,24)/p-1