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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(4-dimethylaminophenyl)propyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(4-dimethylaminophenyl)propyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-[3-(4-dimethylaminophenyl)propyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-[3-(4-dimethylaminophenyl)propyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(4-dimethylaminophenyl)propyl]propionamide Formula: C22H31N5O MolecularWeight: 381.51444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NCCCC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NCCCC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C22H31N5O/c1-17-21(18(2)27(25-17)16-6-14-23)12-13-22(28)24-15-5-7-19-8-10-20(11-9-19)26(3)4/h8-11H,5-7,12-13,15-16H2,1-4H3,(H,24,28)