(E)-3-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(5-ethoxy-2-methyl-coumaran-6-yl)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]prop-2-en-1-one Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=CC(=O)N3CCN(CC3)C4=NC(=NC(=C4)C)C(C)C)OC(C2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1/C=C/C(=O)N3CCN(CC3)C4=NC(=NC(=C4)C)C(C)C)OC(C2)C

InChI

InChI=1S/C26H34N4O3/c1-6-32-22-16-21-14-19(5)33-23(21)15-20(22)7-8-25(31)30-11-9-29(10-12-30)24-13-18(4)27-26(28-24)17(2)3/h7-8,13,15-17,19H,6,9-12,14H2,1-5H3/b8-7+