4-(4-tert-butylphenyl)-5-(2-chlorophenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-tert-butylphenyl)-5-(2-chlorophenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-tert-butylphenyl)-5-(2-chlorophenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-tert-butylphenyl)-5-(2-chlorophenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-tert-butylphenyl)-5-(2-chlorophenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-tert-butylphenyl)-5-(2-chlorophenyl)-1,2,4-triazole-3-thiolate Formula: C18H17ClN3S- MolecularWeight: 342.86568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC=CC=C3Cl

InChI

InChI=1S/C18H18ClN3S/c1-18(2,3)12-8-10-13(11-9-12)22-16(20-21-17(22)23)14-6-4-5-7-15(14)19/h4-11H,1-3H3,(H,21,23)/p-1