3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[(3-pyrrolidin-1-ylcarbonylphenyl)methyl]propanamide

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[(3-pyrrolidin-1-ylcarbonylphenyl)methyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[[3-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-[[3-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-[[3-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(pyrrolidine-1-carbonyl)benzyl]propionamide Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NCC2=CC=CC(=C2)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NCC2=CC=CC(=C2)C(=O)N3CCCC3

InChI

InChI=1S/C23H29N5O2/c1-17-21(18(2)28(26-17)14-6-11-24)9-10-22(29)25-16-19-7-5-8-20(15-19)23(30)27-12-3-4-13-27/h5,7-8,15H,3-4,6,9-10,12-14,16H2,1-2H3,(H,25,29)