6-butyl-5-[(4-iodophenyl)methyl]-2-methyl-1H-pyrimidin-4-one

Systemtic Name: 6-butyl-5-[(4-iodophenyl)methyl]-2-methyl-1H-pyrimidin-4-one Openeye Name: 6-butyl-5-[(4-iodophenyl)methyl]-2-methyl-1H-pyrimidin-4-one CAS Name: 6-butyl-5-[(4-iodophenyl)methyl]-2-methyl-1H-pyrimidin-4-one IUPAC Name: 6-butyl-5-[(4-iodophenyl)methyl]-2-methyl-1H-pyrimidin-4-one Traditional Name: 6-butyl-5-(4-iodobenzyl)-2-methyl-1H-pyrimidin-4-one Formula: C16H19IN2O MolecularWeight: 382.23933

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N=C(N1)C)CC2=CC=C(C=C2)I

Isomeric SMILES

CCCCC1=C(C(=O)N=C(N1)C)CC2=CC=C(C=C2)I

InChI

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