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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-ethyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-ethyl-N-(3-fluoro-4-methoxy-benzyl)propionamide Formula: C21H27FN4O2 MolecularWeight: 386.463083

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)CCC2=C(N(N=C2C)CCC#N)C

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)CCC2=C(N(N=C2C)CCC#N)C

InChI

InChI=1S/C21H27FN4O2/c1-5-25(14-17-7-9-20(28-4)19(22)13-17)21(27)10-8-18-15(2)24-26(16(18)3)12-6-11-23/h7,9,13H,5-6,8,10,12,14H2,1-4H3