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

Systemtic Name: (E)-N-(2-azanyl-2-oxidanylidene-ethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-N-(2-amino-2-oxo-ethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: (E)-N-(2-amino-2-oxoethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-(2-amino-2-oxoethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: (E)-N-(2-amino-2-keto-ethyl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]acrylamide Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O4/c1-29-18-10-8-15(12-19(18)30-2)22-16(9-11-21(28)24-13-20(23)27)14-26(25-22)17-6-4-3-5-7-17/h3-12,14H,13H2,1-2H3,(H2,23,27)(H,24,28)/b11-9+