3-(5-tert-butyl-1H-pyrazol-3-yl)-4-quinolin-5-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-quinolin-5-yl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(5-quinolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(5-quinolinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-quinolin-5-yl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(5-quinolyl)-1H-1,2,4-triazole-5-thione Formula: C18H18N6S MolecularWeight: 350.44072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C2=NNC(=S)N2C3=CC=CC4=C3C=CC=N4

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C2=NNC(=S)N2C3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C18H18N6S/c1-18(2,3)15-10-13(20-21-15)16-22-23-17(25)24(16)14-8-4-7-12-11(14)6-5-9-19-12/h4-10H,1-3H3,(H,20,21)(H,23,25)