2-butyl-3-[(4-iodophenyl)methyl]-6-methyl-pyrimidin-4-one

Systemtic Name: 2-butyl-3-[(4-iodophenyl)methyl]-6-methyl-pyrimidin-4-one Openeye Name: 2-butyl-3-[(4-iodophenyl)methyl]-6-methyl-pyrimidin-4-one CAS Name: 2-butyl-3-[(4-iodophenyl)methyl]-6-methyl-4-pyrimidinone IUPAC Name: 2-butyl-3-[(4-iodophenyl)methyl]-6-methylpyrimidin-4-one Traditional Name: 2-butyl-3-(4-iodobenzyl)-6-methyl-pyrimidin-4-one Formula: C16H19IN2O MolecularWeight: 382.23933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CC(=O)N1CC2=CC=C(C=C2)I)C

Isomeric SMILES

CCCCC1=NC(=CC(=O)N1CC2=CC=C(C=C2)I)C

InChI

InChI=1S/C16H19IN2O/c1-3-4-5-15-18-12(2)10-16(20)19(15)11-13-6-8-14(17)9-7-13/h6-10H,3-5,11H2,1-2H3