3-[4-[4,4-bis(iodanyl)dodecylsulfanyl]phenyl]-1-methyl-5-phenyl-pyridin-4-one

Systemtic Name: 3-[4-[4,4-bis(iodanyl)dodecylsulfanyl]phenyl]-1-methyl-5-phenyl-pyridin-4-one Openeye Name: 3-[4-(4,4-diiodododecylsulfanyl)phenyl]-1-methyl-5-phenyl-pyridin-4-one CAS Name: 3-[4-(4,4-diiodododecylthio)phenyl]-1-methyl-5-phenyl-4-pyridinone IUPAC Name: 3-[4-(4,4-diiodododecylsulfanyl)phenyl]-1-methyl-5-phenylpyridin-4-one Traditional Name: 3-[4-(4,4-diiodododecylthio)phenyl]-1-methyl-5-phenyl-4-pyridone Formula: C30H37I2NOS MolecularWeight: 713.49482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCSC1=CC=C(C=C1)C2=CN(C=C(C2=O)C3=CC=CC=C3)C)(I)I

Isomeric SMILES

CCCCCCCCC(CCCSC1=CC=C(C=C1)C2=CN(C=C(C2=O)C3=CC=CC=C3)C)(I)I

InChI

InChI=1S/C30H37I2NOS/c1-3-4-5-6-7-11-19-30(31,32)20-12-21-35-26-17-15-25(16-18-26)28-23-33(2)22-27(29(28)34)24-13-9-8-10-14-24/h8-10,13-18,22-23H,3-7,11-12,19-21H2,1-2H3