5-ethyl-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one

Systemtic Name: 5-ethyl-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Openeye Name: 5-ethyl-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one CAS Name: 5-ethyl-6-[(E)-2-(3-pyridinyl)ethenyl]-1H-pyrimidin-4-one IUPAC Name: 5-ethyl-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Traditional Name: 5-ethyl-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one Formula: C13H13N3O MolecularWeight: 227.26182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC=NC1=O)C=CC2=CN=CC=C2

Isomeric SMILES

CCC1=C(NC=NC1=O)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C13H13N3O/c1-2-11-12(15-9-16-13(11)17)6-5-10-4-3-7-14-8-10/h3-9H,2H2,1H3,(H,15,16,17)/b6-5+