5-ethyl-2-phenyl-6-propyl-3-prop-2-ynyl-pyrimidin-4-one

Systemtic Name: 5-ethyl-2-phenyl-6-propyl-3-prop-2-ynyl-pyrimidin-4-one Openeye Name: 5-ethyl-2-phenyl-6-propyl-3-prop-2-ynyl-pyrimidin-4-one CAS Name: 5-ethyl-2-phenyl-6-propyl-3-prop-2-ynyl-4-pyrimidinone IUPAC Name: 5-ethyl-2-phenyl-6-propyl-3-prop-2-ynylpyrimidin-4-one Traditional Name: 5-ethyl-2-phenyl-3-propargyl-6-propyl-pyrimidin-4-one Formula: C18H20N2O MolecularWeight: 280.3642

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N(C(=N1)C2=CC=CC=C2)CC#C)CC

Isomeric SMILES

CCCC1=C(C(=O)N(C(=N1)C2=CC=CC=C2)CC#C)CC

InChI

InChI=1S/C18H20N2O/c1-4-10-16-15(6-3)18(21)20(13-5-2)17(19-16)14-11-8-7-9-12-14/h2,7-9,11-12H,4,6,10,13H2,1,3H3