[4-methyl-4-phenyl-2,5-bis(sulfanylidene)imidazolidin-1-yl] hexadecanoate

Systemtic Name: [4-methyl-4-phenyl-2,5-bis(sulfanylidene)imidazolidin-1-yl] hexadecanoate Openeye Name: (4-methyl-4-phenyl-2,5-dithioxo-imidazolidin-1-yl) hexadecanoate CAS Name: hexadecanoic acid [4-methyl-4-phenyl-2,5-bis(sulfanylidene)-1-imidazolidinyl] ester IUPAC Name: [4-methyl-4-phenyl-2,5-bis(sulfanylidene)imidazolidin-1-yl] hexadecanoate Traditional Name: palmitic acid (4-methyl-4-phenyl-2,5-dithioxo-imidazolidin-1-yl) ester Formula: C26H40N2O2S2 MolecularWeight: 476.738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)ON1C(=S)C(NC1=S)(C)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)ON1C(=S)C(NC1=S)(C)C2=CC=CC=C2

InChI

InChI=1S/C26H40N2O2S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-21-23(29)30-28-24(31)26(2,27-25(28)32)22-19-16-15-17-20-22/h15-17,19-20H,3-14,18,21H2,1-2H3,(H,27,32)