(2E,5E)-18,19-bis(methylsulfanyl)-4-oxidanylidene-tricosa-2,5-dienal

Systemtic Name: (2E,5E)-18,19-bis(methylsulfanyl)-4-oxidanylidene-tricosa-2,5-dienal Openeye Name: (2E,5E)-18,19-bis(methylsulfanyl)-4-oxo-tricosa-2,5-dienal CAS Name: (2E,5E)-18,19-bis(methylthio)-4-oxotricosa-2,5-dienal IUPAC Name: (2E,5E)-18,19-bis(methylsulfanyl)-4-oxotricosa-2,5-dienal Traditional Name: (2E,5E)-4-keto-18,19-bis(methylthio)tricosa-2,5-dienal Formula: C25H44O2S2 MolecularWeight: 440.74566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CCCCCCCCCCCC=CC(=O)C=CC=O)SC)SC

Isomeric SMILES

CCCCC(C(CCCCCCCCCCC/C=C/C(=O)/C=C/C=O)SC)SC

InChI

InChI=1S/C25H44O2S2/c1-4-5-20-24(28-2)25(29-3)21-16-14-12-10-8-6-7-9-11-13-15-18-23(27)19-17-22-26/h15,17-19,22,24-25H,4-14,16,20-21H2,1-3H3/b18-15+,19-17+