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

Systemtic Name: (E)-2-cyano-3-[1-[(3-fluorophenyl)methyl]-3-phenyl-pyrazol-4-yl]-N-naphthalen-1-yl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-[(3-fluorophenyl)methyl]-3-phenyl-pyrazol-4-yl]-N-(1-naphthyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[1-[(3-fluorophenyl)methyl]-3-phenyl-4-pyrazolyl]-N-(1-naphthalenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[1-[(3-fluorophenyl)methyl]-3-phenylpyrazol-4-yl]-N-naphthalen-1-ylprop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(3-fluorobenzyl)-3-phenyl-pyrazol-4-yl]-N-(1-naphthyl)acrylamide Formula: C30H21FN4O MolecularWeight: 472.512343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3=CC=CC4=CC=CC=C43)CC5=CC(=CC=C5)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC3=CC=CC4=CC=CC=C43)CC5=CC(=CC=C5)F

InChI

InChI=1S/C30H21FN4O/c31-26-13-6-8-21(16-26)19-35-20-25(29(34-35)23-10-2-1-3-11-23)17-24(18-32)30(36)33-28-15-7-12-22-9-4-5-14-27(22)28/h1-17,20H,19H2,(H,33,36)/b24-17+