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

Systemtic Name: 2-(4-bromophenyl)-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]cinchoninamide Formula: C23H15BrN6O MolecularWeight: 471.3088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)NC4=CN=C(C=C4)N5C=NC=N5

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)NC4=CN=C(C=C4)N5C=NC=N5

InChI

InChI=1S/C23H15BrN6O/c24-16-7-5-15(6-8-16)21-11-19(18-3-1-2-4-20(18)29-21)23(31)28-17-9-10-22(26-12-17)30-14-25-13-27-30/h1-14H,(H,28,31)