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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[2-(3-methylphenoxy)ethyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[2-(3-methylphenoxy)ethyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-[2-(3-methylphenoxy)ethyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-[2-(3-methylphenoxy)ethyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[2-(3-methylphenoxy)ethyl]propionamide Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)CCC2=C(N(N=C2C)CCC#N)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)CCC2=C(N(N=C2C)CCC#N)C

InChI

InChI=1S/C20H26N4O2/c1-15-6-4-7-18(14-15)26-13-11-22-20(25)9-8-19-16(2)23-24(17(19)3)12-5-10-21/h4,6-7,14H,5,8-9,11-13H2,1-3H3,(H,22,25)