(E)-3-(2-butyl-1-benzofuran-3-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(2-butyl-1-benzofuran-3-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(2-butylbenzofuran-3-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-(2-butyl-3-benzofuranyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(2-butyl-1-benzofuran-3-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(2-butylbenzofuran-3-yl)-1-[4-(2-pyrimidyl)piperazino]prop-2-en-1-one Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C=CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)/C=C/C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H26N4O2/c1-2-3-8-20-19(18-7-4-5-9-21(18)29-20)10-11-22(28)26-14-16-27(17-15-26)23-24-12-6-13-25-23/h4-7,9-13H,2-3,8,14-17H2,1H3/b11-10+