2-[(3-iodanylphenyl)methylsulfanyl]-6-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 2-[(3-iodanylphenyl)methylsulfanyl]-6-methylsulfanyl-pyrimidin-4-amine Openeye Name: 2-[(3-iodophenyl)methylsulfanyl]-6-methylsulfanyl-pyrimidin-4-amine CAS Name: 2-[(3-iodophenyl)methylthio]-6-(methylthio)-4-pyrimidinamine IUPAC Name: 2-[(3-iodophenyl)methylsulfanyl]-6-methylsulfanylpyrimidin-4-amine Traditional Name: [2-[(3-iodobenzyl)thio]-6-(methylthio)pyrimidin-4-yl]amine Formula: C12H12IN3S2 MolecularWeight: 389.27825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1)N)SCC2=CC(=CC=C2)I

Isomeric SMILES

CSC1=NC(=NC(=C1)N)SCC2=CC(=CC=C2)I

InChI

InChI=1S/C12H12IN3S2/c1-17-11-6-10(14)15-12(16-11)18-7-8-3-2-4-9(13)5-8/h2-6H,7H2,1H3,(H2,14,15,16)