6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-5-pentyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-5-pentyl-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-5-pentyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-5-pentyl-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-5-pentyl-1H-pyrimidin-4-one Traditional Name: 5-amyl-6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-1H-pyrimidin-4-one Formula: C18H21ClN2O MolecularWeight: 316.82514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(NC=NC1=O)C=C(C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCC1=C(NC=NC1=O)/C=C(\C)/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H21ClN2O/c1-3-4-5-6-16-17(20-12-21-18(16)22)11-13(2)14-7-9-15(19)10-8-14/h7-12H,3-6H2,1-2H3,(H,20,21,22)/b13-11+