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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[4-(4-ethoxyphenoxy)phenyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[4-(4-ethoxyphenoxy)phenyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-[4-(4-ethoxyphenoxy)phenyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-[4-(4-ethoxyphenoxy)phenyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[4-(4-ethoxyphenoxy)phenyl]propionamide Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCC3=C(N(N=C3C)CCC#N)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCC3=C(N(N=C3C)CCC#N)C

InChI

InChI=1S/C25H28N4O3/c1-4-31-21-10-12-23(13-11-21)32-22-8-6-20(7-9-22)27-25(30)15-14-24-18(2)28-29(19(24)3)17-5-16-26/h6-13H,4-5,14-15,17H2,1-3H3,(H,27,30)