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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-methyl-N-[(4-morpholinophenyl)methyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-methyl-N-[[4-(4-morpholinyl)phenyl]methyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-methyl-N-(4-morpholinobenzyl)propionamide Formula: C23H31N5O2 MolecularWeight: 409.52454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)N(C)CC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)N(C)CC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C23H31N5O2/c1-18-22(19(2)28(25-18)12-4-11-24)9-10-23(29)26(3)17-20-5-7-21(8-6-20)27-13-15-30-16-14-27/h5-8H,4,9-10,12-17H2,1-3H3