3-(2-tert-butylpyrimidin-5-yl)prop-1-en-1-one

Systemtic Name: 3-(2-tert-butylpyrimidin-5-yl)prop-1-en-1-one Openeye Name: 3-(2-tert-butylpyrimidin-5-yl)prop-1-en-1-one CAS Name: 3-(2-tert-butyl-5-pyrimidinyl)-1-propen-1-one IUPAC Name: 3-(2-tert-butylpyrimidin-5-yl)prop-1-en-1-one Traditional Name: 3-(2-tert-butylpyrimidin-5-yl)prop-1-en-1-one Formula: C11H14N2O MolecularWeight: 190.24166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C(C=N1)CC=C=O

Isomeric SMILES

CC(C)(C)C1=NC=C(C=N1)CC=C=O

InChI

InChI=1S/C11H14N2O/c1-11(2,3)10-12-7-9(8-13-10)5-4-6-14/h4,7-8H,5H2,1-3H3