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

Systemtic Name: 5-(2-methylpropyl)-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Openeye Name: 5-isobutyl-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one CAS Name: 5-(2-methylpropyl)-6-[(E)-2-(3-pyridinyl)ethenyl]-1H-pyrimidin-4-one IUPAC Name: 5-(2-methylpropyl)-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Traditional Name: 5-isobutyl-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one Formula: C15H17N3O MolecularWeight: 255.31498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(NC=NC1=O)C=CC2=CN=CC=C2

Isomeric SMILES

CC(C)CC1=C(NC=NC1=O)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C15H17N3O/c1-11(2)8-13-14(17-10-18-15(13)19)6-5-12-4-3-7-16-9-12/h3-7,9-11H,8H2,1-2H3,(H,17,18,19)/b6-5+