N-(1-methylpiperidin-4-yl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-(1-methylpiperidin-4-yl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(1-methyl-4-piperidyl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(1-methyl-4-piperidinyl)-2-(1,3,5-trimethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(1-methylpiperidin-4-yl)-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(1-methyl-4-piperidyl)-2-(1,3,5-trimethylpyrazol-4-yl)cinchoninamide Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCN(CC4)C

Isomeric SMILES

CC1=C(C(=NN1C)C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCN(CC4)C

InChI

InChI=1S/C22H27N5O/c1-14-21(15(2)27(4)25-14)20-13-18(17-7-5-6-8-19(17)24-20)22(28)23-16-9-11-26(3)12-10-16/h5-8,13,16H,9-12H2,1-4H3,(H,23,28)