(2S)-2-[(1R)-1-oxidanyltetradecyl]-1-[(4S)-4-phenyl-2-sulfanylidene-1,3-thiazolidin-3-yl]icosan-1-one

Systemtic Name: (2S)-2-[(1R)-1-oxidanyltetradecyl]-1-[(4S)-4-phenyl-2-sulfanylidene-1,3-thiazolidin-3-yl]icosan-1-one Openeye Name: (2S)-2-[(1R)-1-hydroxytetradecyl]-1-[(4S)-4-phenyl-2-thioxo-thiazolidin-3-yl]icosan-1-one CAS Name: (2S)-2-[(1R)-1-hydroxytetradecyl]-1-[(4S)-4-phenyl-2-sulfanylidene-3-thiazolidinyl]-1-eicosanone IUPAC Name: (2S)-2-[(1R)-1-hydroxytetradecyl]-1-[(4S)-4-phenyl-2-sulfanylidene-1,3-thiazolidin-3-yl]icosan-1-one Traditional Name: (2S)-2-[(1R)-1-hydroxytetradecyl]-1-[(4S)-4-phenyl-2-thioxo-thiazolidin-3-yl]eicosan-1-one Formula: C43H75NO2S2 MolecularWeight: 702.1911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C(CCCCCCCCCCCCC)O)C(=O)N1C(CSC1=S)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[C@@H]([C@@H](CCCCCCCCCCCCC)O)C(=O)N1[C@H](CSC1=S)C2=CC=CC=C2

InChI

InChI=1S/C43H75NO2S2/c1-3-5-7-9-11-13-15-16-17-18-19-21-22-24-26-31-35-39(41(45)36-32-27-25-23-20-14-12-10-8-6-4-2)42(46)44-40(37-48-43(44)47)38-33-29-28-30-34-38/h28-30,33-34,39-41,45H,3-27,31-32,35-37H2,1-2H3/t39-,40+,41+/m0/s1