N-(5-chloranyl-2-oxidanyl-phenyl)-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-oxidanyl-phenyl)-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(5-chloro-2-hydroxy-phenyl)-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(5-chloro-2-hydroxyphenyl)-2-(1-ethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(5-chloro-2-hydroxyphenyl)-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(5-chloro-2-hydroxy-phenyl)-2-(1-ethylpyrazol-4-yl)cinchoninamide Formula: C21H17ClN4O2 MolecularWeight: 392.83828

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)Cl)O

Isomeric SMILES

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C21H17ClN4O2/c1-2-26-12-13(11-23-26)18-10-16(15-5-3-4-6-17(15)24-18)21(28)25-19-9-14(22)7-8-20(19)27/h3-12,27H,2H2,1H3,(H,25,28)