3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-quinolin-8-yl-propanamide

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-quinolin-8-yl-propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(8-quinolyl)propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-(8-quinolinyl)propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-quinolin-8-ylpropanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(8-quinolyl)propionamide Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C20H21N5O/c1-14-17(15(2)25(24-14)13-5-11-21)9-10-19(26)23-18-8-3-6-16-7-4-12-22-20(16)18/h3-4,6-8,12H,5,9-10,13H2,1-2H3,(H,23,26)