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

Systemtic Name: 4-(1,3-dimethylpyrazol-4-yl)-5-(2-methylfuran-3-yl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(1,3-dimethylpyrazol-4-yl)-5-(2-methyl-3-furyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(1,3-dimethyl-4-pyrazolyl)-5-(2-methyl-3-furanyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(1,3-dimethylpyrazol-4-yl)-5-(2-methylfuran-3-yl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(1,3-dimethylpyrazol-4-yl)-5-(2-methyl-3-furyl)-1,2,4-triazole-3-thiolate Formula: C12H12N5OS- MolecularWeight: 274.32158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C3=CN(N=C3C)C)[S-]

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C3=CN(N=C3C)C)[S-]

InChI

InChI=1S/C12H13N5OS/c1-7-10(6-16(3)15-7)17-11(13-14-12(17)19)9-4-5-18-8(9)2/h4-6H,1-3H3,(H,14,19)/p-1