4-(2,6-diethylphenyl)-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2,6-diethylphenyl)-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2,6-diethylphenyl)-3-(3-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,6-diethylphenyl)-3-(3-pyridinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2,6-diethylphenyl)-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2,6-diethylphenyl)-3-(3-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2C(=NNC2=S)C3=CN=CC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C(=NNC2=S)C3=CN=CC=C3

InChI

InChI=1S/C17H18N4S/c1-3-12-7-5-8-13(4-2)15(12)21-16(19-20-17(21)22)14-9-6-10-18-11-14/h5-11H,3-4H2,1-2H3,(H,20,22)