(E)-2-cyano-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[2-(pyridin-2-ylmethoxy)phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[2-(pyridin-2-ylmethoxy)phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[2-(2-pyridylmethoxy)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[2-(2-pyridinylmethoxy)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[2-(pyridin-2-ylmethoxy)phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-[2-(2-pyridylmethoxy)phenyl]acrylamide Formula: C27H23N5O3 MolecularWeight: 465.50322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(=CC3=CC=CC=C3OCC4=CC=CC=N4)C#N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)/C(=C/C3=CC=CC=C3OCC4=CC=CC=N4)/C#N

InChI

InChI=1S/C27H23N5O3/c1-19-25(27(34)32(31(19)2)23-12-4-3-5-13-23)30-26(33)21(17-28)16-20-10-6-7-14-24(20)35-18-22-11-8-9-15-29-22/h3-16H,18H2,1-2H3,(H,30,33)/b21-16+