(E)-N-(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-N-(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-N-(2-amino-2-oxo-1-phenyl-ethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: (E)-N-(2-amino-2-oxo-1-phenylethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-(2-amino-2-oxo-1-phenylethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: (E)-N-(2-amino-2-keto-1-phenyl-ethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]acrylamide Formula: C28H26N4O4 MolecularWeight: 482.53044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)NC(C3=CC=CC=C3)C(=O)N)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2/C=C/C(=O)NC(C3=CC=CC=C3)C(=O)N)C4=CC=CC=C4)OC

InChI

InChI=1S/C28H26N4O4/c1-35-23-15-13-20(17-24(23)36-2)26-21(18-32(31-26)22-11-7-4-8-12-22)14-16-25(33)30-27(28(29)34)19-9-5-3-6-10-19/h3-18,27H,1-2H3,(H2,29,34)(H,30,33)/b16-14+