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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(imidazol-1-ylmethyl)phenyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(imidazol-1-ylmethyl)phenyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-[3-(1-imidazolylmethyl)phenyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-[3-(imidazol-1-ylmethyl)phenyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(imidazol-1-ylmethyl)phenyl]propionamide Formula: C21H24N6O MolecularWeight: 376.45486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC2=CC=CC(=C2)CN3C=CN=C3

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC2=CC=CC(=C2)CN3C=CN=C3

InChI

InChI=1S/C21H24N6O/c1-16-20(17(2)27(25-16)11-4-9-22)7-8-21(28)24-19-6-3-5-18(13-19)14-26-12-10-23-15-26/h3,5-6,10,12-13,15H,4,7-8,11,14H2,1-2H3,(H,24,28)