(E)-3-(4-decoxy-3,5-dimethoxy-phenyl)-N-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-decoxy-3,5-dimethoxy-phenyl)-N-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-enamide Openeye Name: (E)-3-(4-decoxy-3,5-dimethoxy-phenyl)-N-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-enamide CAS Name: (E)-3-(4-decoxy-3,5-dimethoxyphenyl)-N-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propenamide IUPAC Name: (E)-3-(4-decoxy-3,5-dimethoxyphenyl)-N-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-enamide Traditional Name: (E)-3-(4-decoxy-3,5-dimethoxy-phenyl)-N-[4-(2-pyrimidyl)piperazino]acrylamide Formula: C29H43N5O4 MolecularWeight: 525.68282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1OC)C=CC(=O)NN2CCN(CC2)C3=NC=CC=N3)OC

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1OC)/C=C/C(=O)NN2CCN(CC2)C3=NC=CC=N3)OC

InChI

InChI=1S/C29H43N5O4/c1-4-5-6-7-8-9-10-11-21-38-28-25(36-2)22-24(23-26(28)37-3)13-14-27(35)32-34-19-17-33(18-20-34)29-30-15-12-16-31-29/h12-16,22-23H,4-11,17-21H2,1-3H3,(H,32,35)/b14-13+