N-[3-[(E)-3-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]prop-2-enoyl]phenyl]ethanamide

Systemtic Name: N-[3-[(E)-3-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]prop-2-enoyl]phenyl]ethanamide Openeye Name: N-[3-[(E)-3-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]prop-2-enoyl]phenyl]acetamide CAS Name: N-[3-[(E)-3-[1-(2-cyanoethyl)-3-phenyl-4-pyrazolyl]-1-oxoprop-2-enyl]phenyl]acetamide IUPAC Name: N-[3-[(E)-3-[1-(2-cyanoethyl)-3-phenylpyrazol-4-yl]prop-2-enoyl]phenyl]acetamide Traditional Name: N-[3-[(E)-3-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]acryloyl]phenyl]acetamide Formula: C23H20N4O2 MolecularWeight: 384.4305

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)C=CC2=CN(N=C2C3=CC=CC=C3)CCC#N

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)/C=C/C2=CN(N=C2C3=CC=CC=C3)CCC#N

InChI

InChI=1S/C23H20N4O2/c1-17(28)25-21-10-5-9-19(15-21)22(29)12-11-20-16-27(14-6-13-24)26-23(20)18-7-3-2-4-8-18/h2-5,7-12,15-16H,6,14H2,1H3,(H,25,28)/b12-11+