4-(2,5-dimethylphenyl)-5-(4-ethyl-5-methyl-thiophen-3-yl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(2,5-dimethylphenyl)-5-(4-ethyl-5-methyl-thiophen-3-yl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(2,5-dimethylphenyl)-5-(4-ethyl-5-methyl-3-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(2,5-dimethylphenyl)-5-(4-ethyl-5-methyl-3-thiophenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(2,5-dimethylphenyl)-5-(4-ethyl-5-methylthiophen-3-yl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(2,5-dimethylphenyl)-5-(4-ethyl-5-methyl-3-thienyl)-1,2,4-triazole-3-thiolate Formula: C17H18N3S2- MolecularWeight: 328.47492

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C2=NN=C(N2C3=C(C=CC(=C3)C)C)[S-])C

Isomeric SMILES

CCC1=C(SC=C1C2=NN=C(N2C3=C(C=CC(=C3)C)C)[S-])C

InChI

InChI=1S/C17H19N3S2/c1-5-13-12(4)22-9-14(13)16-18-19-17(21)20(16)15-8-10(2)6-7-11(15)3/h6-9H,5H2,1-4H3,(H,19,21)/p-1