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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-methyl-N-[[2-(1-pyrrolidinyl)phenyl]methyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-methyl-N-(2-pyrrolidinobenzyl)propionamide Formula: C23H31N5O MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)N(C)CC2=CC=CC=C2N3CCCC3

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)N(C)CC2=CC=CC=C2N3CCCC3

InChI

InChI=1S/C23H31N5O/c1-18-21(19(2)28(25-18)16-8-13-24)11-12-23(29)26(3)17-20-9-4-5-10-22(20)27-14-6-7-15-27/h4-5,9-10H,6-8,11-12,14-17H2,1-3H3