5-(1,3-benzodioxol-5-yl)-4-quinolin-5-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-4-quinolin-5-yl-1,2,4-triazole-3-thiolate Openeye Name: 5-(1,3-benzodioxol-5-yl)-4-(5-quinolyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(1,3-benzodioxol-5-yl)-4-(5-quinolinyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(1,3-benzodioxol-5-yl)-4-quinolin-5-yl-1,2,4-triazole-3-thiolate Traditional Name: 5-(1,3-benzodioxol-5-yl)-4-(5-quinolyl)-1,2,4-triazole-3-thiolate Formula: C18H11N4O2S- MolecularWeight: 347.37054

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN=C(N3C4=CC=CC5=C4C=CC=N5)[S-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN=C(N3C4=CC=CC5=C4C=CC=N5)[S-]

InChI

InChI=1S/C18H12N4O2S/c25-18-21-20-17(11-6-7-15-16(9-11)24-10-23-15)22(18)14-5-1-4-13-12(14)3-2-8-19-13/h1-9H,10H2,(H,21,25)/p-1