(E)-3-[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]-2-cyano-N-propan-2-yl-prop-2-enamide

Systemtic Name: (E)-3-[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-[1-[(2-chlorophenyl)methyl]-3-phenyl-4-pyrazolyl]-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-[1-[(2-chlorophenyl)methyl]-3-phenylpyrazol-4-yl]-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-[1-(2-chlorobenzyl)-3-phenyl-pyrazol-4-yl]-2-cyano-N-isopropyl-acrylamide Formula: C23H21ClN4O MolecularWeight: 404.89204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3Cl)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3Cl)/C#N

InChI

InChI=1S/C23H21ClN4O/c1-16(2)26-23(29)19(13-25)12-20-15-28(14-18-10-6-7-11-21(18)24)27-22(20)17-8-4-3-5-9-17/h3-12,15-16H,14H2,1-2H3,(H,26,29)/b19-12+