5-(2,5-dimethylpyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(2,5-dimethylpyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(2,5-dimethylpyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(2,5-dimethyl-3-pyrazolyl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(2,5-dimethylpyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(2,5-dimethylpyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C14H14N5OS- MolecularWeight: 300.35886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=NN=C(N2C3=CC=CC=C3OC)[S-])C

Isomeric SMILES

CC1=NN(C(=C1)C2=NN=C(N2C3=CC=CC=C3OC)[S-])C

InChI

InChI=1S/C14H15N5OS/c1-9-8-11(18(2)17-9)13-15-16-14(21)19(13)10-6-4-5-7-12(10)20-3/h4-8H,1-3H3,(H,16,21)/p-1