(E)-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-cyano-N-phenethyl-prop-2-enamide

Systemtic Name: (E)-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-cyano-N-phenethyl-prop-2-enamide Openeye Name: (E)-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-cyano-N-phenethyl-prop-2-enamide CAS Name: (E)-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-2-cyano-N-phenethyl-2-propenamide IUPAC Name: (E)-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-2-cyano-N-phenethylprop-2-enamide Traditional Name: (E)-3-[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-2-cyano-N-phenethyl-acrylamide Formula: C24H23ClN4O MolecularWeight: 418.91862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C=C(C#N)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)/C=C(\C#N)/C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C24H23ClN4O/c1-17-22(18(2)29(28-17)16-20-10-6-7-11-23(20)25)14-21(15-26)24(30)27-13-12-19-8-4-3-5-9-19/h3-11,14H,12-13,16H2,1-2H3,(H,27,30)/b21-14+