(E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]-1-[4-(2-pyrimidyl)piperazino]prop-2-en-1-one Formula: C27H30N4O4 MolecularWeight: 474.5515

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)N2CCN(CC2)C3=NC=CC=N3)OCCOC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)N2CCN(CC2)C3=NC=CC=N3)OCCOC4=CC=CC=C4

InChI

InChI=1S/C27H30N4O4/c1-2-33-25-21-22(9-11-24(25)35-20-19-34-23-7-4-3-5-8-23)10-12-26(32)30-15-17-31(18-16-30)27-28-13-6-14-29-27/h3-14,21H,2,15-20H2,1H3/b12-10+