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

Systemtic Name: (E)-2-cyano-N-cyclopropyl-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)-2-cyano-N-cyclopropyl-prop-2-enamide CAS Name: (E)-2-cyano-N-cyclopropyl-3-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(1-benzyl-3-phenylpyrazol-4-yl)-2-cyano-N-cyclopropylprop-2-enamide Traditional Name: (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)-2-cyano-N-cyclopropyl-acrylamide Formula: C23H20N4O MolecularWeight: 368.4311

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(=CC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4)C#N

Isomeric SMILES

C1CC1NC(=O)/C(=C/C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4)/C#N

InChI

InChI=1S/C23H20N4O/c24-14-19(23(28)25-21-11-12-21)13-20-16-27(15-17-7-3-1-4-8-17)26-22(20)18-9-5-2-6-10-18/h1-10,13,16,21H,11-12,15H2,(H,25,28)/b19-13+