N-[(2S)-butan-2-yl]-7-methoxy-2-(1H-pyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-7-methoxy-2-(1H-pyrazol-4-yl)quinoline-4-carboxamide Openeye Name: 7-methoxy-N-[(1S)-1-methylpropyl]-2-(1H-pyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-7-methoxy-2-(1H-pyrazol-4-yl)-4-quinolinecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-7-methoxy-2-(1H-pyrazol-4-yl)quinoline-4-carboxamide Traditional Name: 7-methoxy-N-[(1S)-1-methylpropyl]-2-(1H-pyrazol-4-yl)cinchoninamide Formula: C18H20N4O2 MolecularWeight: 324.377

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NC2=C1C=CC(=C2)OC)C3=CNN=C3

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC(=NC2=C1C=CC(=C2)OC)C3=CNN=C3

InChI

InChI=1S/C18H20N4O2/c1-4-11(2)21-18(23)15-8-16(12-9-19-20-10-12)22-17-7-13(24-3)5-6-14(15)17/h5-11H,4H2,1-3H3,(H,19,20)(H,21,23)/t11-/m0/s1