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

Systemtic Name: 5-(4-ethyl-5-methyl-thiophen-3-yl)-4-(3-methylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-ethyl-5-methyl-3-thienyl)-4-(m-tolyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(4-ethyl-5-methyl-3-thiophenyl)-4-(3-methylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-ethyl-5-methylthiophen-3-yl)-4-(3-methylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-ethyl-5-methyl-3-thienyl)-4-(m-tolyl)-1,2,4-triazole-3-thiolate Formula: C16H16N3S2- MolecularWeight: 314.44834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3S2/c1-4-13-11(3)21-9-14(13)15-17-18-16(20)19(15)12-7-5-6-10(2)8-12/h5-9H,4H2,1-3H3,(H,18,20)/p-1