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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-phenylmethoxy-propanamide Openeye Name: N-benzyloxy-3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-phenylmethoxypropanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-phenylmethoxypropanamide Traditional Name: N-benzoxy-3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propionamide Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NOCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NOCC2=CC=CC=C2

InChI

InChI=1S/C18H22N4O2/c1-14-17(15(2)22(20-14)12-6-11-19)9-10-18(23)21-24-13-16-7-4-3-5-8-16/h3-5,7-8H,6,9-10,12-13H2,1-2H3,(H,21,23)