4-ethyl-3-[2-(4-ethylphenyl)quinolin-4-yl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-ethyl-3-[2-(4-ethylphenyl)quinolin-4-yl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-ethyl-3-[2-(4-ethylphenyl)-4-quinolyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-ethyl-3-[2-(4-ethylphenyl)-4-quinolinyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-ethyl-3-[2-(4-ethylphenyl)quinolin-4-yl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-ethyl-3-[2-(4-ethylphenyl)-4-quinolyl]-1H-1,2,4-triazole-5-thione Formula: C21H20N4S MolecularWeight: 360.4753

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NNC(=S)N4CC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NNC(=S)N4CC

InChI

InChI=1S/C21H20N4S/c1-3-14-9-11-15(12-10-14)19-13-17(16-7-5-6-8-18(16)22-19)20-23-24-21(26)25(20)4-2/h5-13H,3-4H2,1-2H3,(H,24,26)