(E)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]-3-(2,4,5-trimethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-asaryl-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]acrylamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)NCC2=C(N=CC=C2)N3C=CC=N3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)NCC2=C(N=CC=C2)N3C=CC=N3)OC)OC

InChI

InChI=1S/C21H22N4O4/c1-27-17-13-19(29-3)18(28-2)12-15(17)7-8-20(26)23-14-16-6-4-9-22-21(16)25-11-5-10-24-25/h4-13H,14H2,1-3H3,(H,23,26)/b8-7+