5-propyl-4-quinolin-5-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-propyl-4-quinolin-5-yl-1,2,4-triazole-3-thiolate Openeye Name: 5-propyl-4-(5-quinolyl)-1,2,4-triazole-3-thiolate CAS Name: 5-propyl-4-(5-quinolinyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-propyl-4-quinolin-5-yl-1,2,4-triazole-3-thiolate Traditional Name: 5-propyl-4-(5-quinolyl)-1,2,4-triazole-3-thiolate Formula: C14H13N4S- MolecularWeight: 269.34482

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2=CC=CC3=C2C=CC=N3)[S-]

Isomeric SMILES

CCCC1=NN=C(N1C2=CC=CC3=C2C=CC=N3)[S-]

InChI

InChI=1S/C14H14N4S/c1-2-5-13-16-17-14(19)18(13)12-8-3-7-11-10(12)6-4-9-15-11/h3-4,6-9H,2,5H2,1H3,(H,17,19)/p-1