(E)-2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]-N-(1-phenylethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)acrylamide Formula: C27H21FN4O MolecularWeight: 436.480243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4)C#N

Isomeric SMILES

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

InChI

InChI=1S/C27H21FN4O/c1-19(20-8-4-2-5-9-20)30-27(33)22(17-29)16-23-18-32(25-10-6-3-7-11-25)31-26(23)21-12-14-24(28)15-13-21/h2-16,18-19H,1H3,(H,30,33)/b22-16+