2-but-2-ynyl-6-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-but-2-ynyl-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-but-2-ynyl-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-but-2-ynyl-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-but-2-ynyl-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-but-2-ynyl-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C13H11N3O MolecularWeight: 225.24594

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC1=NC(=O)C=C(N1)C2=CC=NC=C2

Isomeric SMILES

CC#CCC1=NC(=O)C=C(N1)C2=CC=NC=C2

InChI

InChI=1S/C13H11N3O/c1-2-3-4-12-15-11(9-13(17)16-12)10-5-7-14-8-6-10/h5-9H,4H2,1H3,(H,15,16,17)