2-(4-methylphenyl)-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]quinoline-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]quinoline-4-carboxamide Openeye Name: 2-(p-tolyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]quinoline-4-carboxamide CAS Name: 2-(4-methylphenyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-methylphenyl)-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]quinoline-4-carboxamide Traditional Name: 2-(p-tolyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]cinchoninamide Formula: C24H18N6O MolecularWeight: 406.43932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CN=C(C=C4)N5C=NC=N5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CN=C(C=C4)N5C=NC=N5

InChI

InChI=1S/C24H18N6O/c1-16-6-8-17(9-7-16)22-12-20(19-4-2-3-5-21(19)29-22)24(31)28-18-10-11-23(26-13-18)30-15-25-14-27-30/h2-15H,1H3,(H,28,31)