5-[2-(4-butoxyphenyl)quinolin-4-yl]-4-ethyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[2-(4-butoxyphenyl)quinolin-4-yl]-4-ethyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[2-(4-butoxyphenyl)-4-quinolyl]-4-ethyl-1,2,4-triazole-3-thiolate CAS Name: 5-[2-(4-butoxyphenyl)-4-quinolinyl]-4-ethyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[2-(4-butoxyphenyl)quinolin-4-yl]-4-ethyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[2-(4-butoxyphenyl)-4-quinolyl]-4-ethyl-1,2,4-triazole-3-thiolate Formula: C23H23N4OS- MolecularWeight: 403.51992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4CC)[S-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4CC)[S-]

InChI

InChI=1S/C23H24N4OS/c1-3-5-14-28-17-12-10-16(11-13-17)21-15-19(18-8-6-7-9-20(18)24-21)22-25-26-23(29)27(22)4-2/h6-13,15H,3-5,14H2,1-2H3,(H,26,29)/p-1