4-azanyl-5-[2-(4-methylphenyl)quinolin-4-yl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-azanyl-5-[2-(4-methylphenyl)quinolin-4-yl]-1,2,4-triazole-3-thiolate Openeye Name: 4-amino-5-[2-(p-tolyl)-4-quinolyl]-1,2,4-triazole-3-thiolate CAS Name: 4-amino-5-[2-(4-methylphenyl)-4-quinolinyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-amino-5-[2-(4-methylphenyl)quinolin-4-yl]-1,2,4-triazole-3-thiolate Traditional Name: 4-amino-5-[2-(p-tolyl)-4-quinolyl]-1,2,4-triazole-3-thiolate Formula: C18H14N5S- MolecularWeight: 332.40226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4N)[S-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4N)[S-]

InChI

InChI=1S/C18H15N5S/c1-11-6-8-12(9-7-11)16-10-14(17-21-22-18(24)23(17)19)13-4-2-3-5-15(13)20-16/h2-10H,19H2,1H3,(H,22,24)/p-1