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

Systemtic Name: (E)-3-pyridin-4-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(4-pyridyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-pyridin-4-yl-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-pyridin-4-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(4-pyridyl)-1-[4-(2-pyrimidyl)piperazino]prop-2-en-1-one Formula: C16H17N5O MolecularWeight: 295.33908

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C=CC3=CC=NC=C3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)/C=C/C3=CC=NC=C3

InChI

InChI=1S/C16H17N5O/c22-15(3-2-14-4-8-17-9-5-14)20-10-12-21(13-11-20)16-18-6-1-7-19-16/h1-9H,10-13H2/b3-2+