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

Systemtic Name: 3-[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]-4-ethyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-(1,3-benzodioxol-5-yl)-4-quinolyl]-4-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(1,3-benzodioxol-5-yl)-4-quinolinyl]-4-ethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]-4-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-(1,3-benzodioxol-5-yl)-4-quinolyl]-4-ethyl-1H-1,2,4-triazole-5-thione Formula: C20H16N4O2S MolecularWeight: 376.43164

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN1C(=NNC1=S)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H16N4O2S/c1-2-24-19(22-23-20(24)27)14-10-16(21-15-6-4-3-5-13(14)15)12-7-8-17-18(9-12)26-11-25-17/h3-10H,2,11H2,1H3,(H,23,27)