(E)-3-(2,3-dihydro-1-benzofuran-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(2,3-dihydro-1-benzofuran-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(2,3-dihydrobenzofuran-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-(2,3-dihydrobenzofuran-5-yl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(2,3-dihydro-1-benzofuran-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-coumaran-5-yl-1-[4-(2-pyrimidyl)piperazino]prop-2-en-1-one Formula: C19H20N4O2 MolecularWeight: 336.3877

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C=CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1COC2=C1C=C(C=C2)/C=C/C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H20N4O2/c24-18(5-3-15-2-4-17-16(14-15)6-13-25-17)22-9-11-23(12-10-22)19-20-7-1-8-21-19/h1-5,7-8,14H,6,9-13H2/b5-3+