5-(1-benzothiophen-3-yl)-4-(2,5-dimethylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(1-benzothiophen-3-yl)-4-(2,5-dimethylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(benzothiophen-3-yl)-4-(2,5-dimethylphenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(1-benzothiophen-3-yl)-4-(2,5-dimethylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(1-benzothiophen-3-yl)-4-(2,5-dimethylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(benzothiophen-3-yl)-4-(2,5-dimethylphenyl)-1,2,4-triazole-3-thiolate Formula: C18H14N3S2- MolecularWeight: 336.45386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=NN=C2[S-])C3=CSC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=NN=C2[S-])C3=CSC4=CC=CC=C43

InChI

InChI=1S/C18H15N3S2/c1-11-7-8-12(2)15(9-11)21-17(19-20-18(21)22)14-10-23-16-6-4-3-5-13(14)16/h3-10H,1-2H3,(H,20,22)/p-1