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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(pyridin-2-ylmethyl)propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(2-pyridylmethyl)propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-(2-pyridinylmethyl)propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-(pyridin-2-ylmethyl)propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(2-pyridylmethyl)propionamide Formula: C17H21N5O MolecularWeight: 311.38154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NCC2=CC=CC=N2

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NCC2=CC=CC=N2

InChI

InChI=1S/C17H21N5O/c1-13-16(14(2)22(21-13)11-5-9-18)7-8-17(23)20-12-15-6-3-4-10-19-15/h3-4,6,10H,5,7-8,11-12H2,1-2H3,(H,20,23)