6-chloranyl-N-[(3S)-oxan-3-yl]-2-(1H-pyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-N-[(3S)-oxan-3-yl]-2-(1H-pyrazol-4-yl)quinoline-4-carboxamide Openeye Name: 6-chloro-2-(1H-pyrazol-4-yl)-N-[(3S)-tetrahydropyran-3-yl]quinoline-4-carboxamide CAS Name: 6-chloro-N-[(3S)-3-oxanyl]-2-(1H-pyrazol-4-yl)-4-quinolinecarboxamide IUPAC Name: 6-chloro-N-[(3S)-oxan-3-yl]-2-(1H-pyrazol-4-yl)quinoline-4-carboxamide Traditional Name: 6-chloro-2-(1H-pyrazol-4-yl)-N-[(3S)-tetrahydropyran-3-yl]cinchoninamide Formula: C18H17ClN4O2 MolecularWeight: 356.80618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(COC1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CNN=C4

Isomeric SMILES

C1C[C@@H](COC1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CNN=C4

InChI

InChI=1S/C18H17ClN4O2/c19-12-3-4-16-14(6-12)15(7-17(23-16)11-8-20-21-9-11)18(24)22-13-2-1-5-25-10-13/h3-4,6-9,13H,1-2,5,10H2,(H,20,21)(H,22,24)/t13-/m0/s1