2-azanyl-6-(4-tert-butylphenyl)-5-iodanyl-1H-pyrimidin-4-one

Systemtic Name: 2-azanyl-6-(4-tert-butylphenyl)-5-iodanyl-1H-pyrimidin-4-one Openeye Name: 2-amino-6-(4-tert-butylphenyl)-5-iodo-1H-pyrimidin-4-one CAS Name: 2-amino-6-(4-tert-butylphenyl)-5-iodo-1H-pyrimidin-4-one IUPAC Name: 2-amino-6-(4-tert-butylphenyl)-5-iodo-1H-pyrimidin-4-one Traditional Name: 2-amino-6-(4-tert-butylphenyl)-5-iodo-1H-pyrimidin-4-one Formula: C14H16IN3O MolecularWeight: 369.20081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)N)I

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)N)I

InChI

InChI=1S/C14H16IN3O/c1-14(2,3)9-6-4-8(5-7-9)11-10(15)12(19)18-13(16)17-11/h4-7H,1-3H3,(H3,16,17,18,19)