4-[2,6-bis(chloranyl)-3-methyl-phenyl]-5-propyl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2,6-bis(chloranyl)-3-methyl-phenyl]-5-propyl-1,2,4-triazole-3-thiolate Openeye Name: 4-(2,6-dichloro-3-methyl-phenyl)-5-propyl-1,2,4-triazole-3-thiolate CAS Name: 4-(2,6-dichloro-3-methylphenyl)-5-propyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-(2,6-dichloro-3-methylphenyl)-5-propyl-1,2,4-triazole-3-thiolate Traditional Name: 4-(2,6-dichloro-3-methyl-phenyl)-5-propyl-1,2,4-triazole-3-thiolate Formula: C12H12Cl2N3S- MolecularWeight: 301.21478

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2=C(C=CC(=C2Cl)C)Cl)[S-]

Isomeric SMILES

CCCC1=NN=C(N1C2=C(C=CC(=C2Cl)C)Cl)[S-]

InChI

InChI=1S/C12H13Cl2N3S/c1-3-4-9-15-16-12(18)17(9)11-8(13)6-5-7(2)10(11)14/h5-6H,3-4H2,1-2H3,(H,16,18)/p-1