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

Systemtic Name: (E)-3-[1-[(4-bromophenyl)methyl]-3-phenyl-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)prop-2-enamide Openeye Name: (E)-3-[1-[(4-bromophenyl)methyl]-3-phenyl-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)prop-2-enamide CAS Name: (E)-3-[1-[(4-bromophenyl)methyl]-3-phenyl-4-pyrazolyl]-2-cyano-N-(4-ethylphenyl)-2-propenamide IUPAC Name: (E)-3-[1-[(4-bromophenyl)methyl]-3-phenylpyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)prop-2-enamide Traditional Name: (E)-3-[1-(4-bromobenzyl)-3-phenyl-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)acrylamide Formula: C28H23BrN4O MolecularWeight: 511.41242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC=CC=C3)CC4=CC=C(C=C4)Br)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)/C(=C/C2=CN(N=C2C3=CC=CC=C3)CC4=CC=C(C=C4)Br)/C#N

InChI

InChI=1S/C28H23BrN4O/c1-2-20-10-14-26(15-11-20)31-28(34)23(17-30)16-24-19-33(18-21-8-12-25(29)13-9-21)32-27(24)22-6-4-3-5-7-22/h3-16,19H,2,18H2,1H3,(H,31,34)/b23-16+