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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[(4-ethoxy-3-methoxy-phenyl)methyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[(4-ethoxy-3-methoxy-phenyl)methyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-[(4-ethoxy-3-methoxyphenyl)methyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-[(4-ethoxy-3-methoxyphenyl)methyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(4-ethoxy-3-methoxy-benzyl)propionamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)CCC2=C(N(N=C2C)CCC#N)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)CCC2=C(N(N=C2C)CCC#N)C)OC

InChI

InChI=1S/C21H28N4O3/c1-5-28-19-9-7-17(13-20(19)27-4)14-23-21(26)10-8-18-15(2)24-25(16(18)3)12-6-11-22/h7,9,13H,5-6,8,10,12,14H2,1-4H3,(H,23,26)