2-methyl-5-(3-methylbutyl)-6-[(E)-prop-1-enyl]-1H-pyrimidin-4-one

Systemtic Name: 2-methyl-5-(3-methylbutyl)-6-[(E)-prop-1-enyl]-1H-pyrimidin-4-one Openeye Name: 5-isopentyl-2-methyl-6-[(E)-prop-1-enyl]-1H-pyrimidin-4-one CAS Name: 2-methyl-5-(3-methylbutyl)-6-[(E)-prop-1-enyl]-1H-pyrimidin-4-one IUPAC Name: 2-methyl-5-(3-methylbutyl)-6-[(E)-prop-1-enyl]-1H-pyrimidin-4-one Traditional Name: 5-isoamyl-2-methyl-6-[(E)-prop-1-enyl]-1H-pyrimidin-4-one Formula: C13H20N2O MolecularWeight: 220.3107

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=C(C(=O)N=C(N1)C)CCC(C)C

Isomeric SMILES

C/C=C/C1=C(C(=O)N=C(N1)C)CCC(C)C

InChI

InChI=1S/C13H20N2O/c1-5-6-12-11(8-7-9(2)3)13(16)15-10(4)14-12/h5-6,9H,7-8H2,1-4H3,(H,14,15,16)/b6-5+