2-[(5E)-4-oxidanylidene-5-(1-phenyloctadecylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid

Systemtic Name: 2-[(5E)-4-oxidanylidene-5-(1-phenyloctadecylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid Openeye Name: 2-[(5E)-4-oxo-5-(1-phenyloctadecylidene)-2-thioxo-thiazolidin-3-yl]acetic acid CAS Name: 2-[(5E)-4-oxo-5-(1-phenyloctadecylidene)-2-sulfanylidene-3-thiazolidinyl]acetic acid IUPAC Name: 2-[(5E)-4-oxo-5-(1-phenyloctadecylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid Traditional Name: 2-[(5E)-4-keto-5-(1-phenyloctadecylidene)-2-thioxo-thiazolidin-3-yl]acetic acid Formula: C29H43NO3S2 MolecularWeight: 517.78662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=C1C(=O)N(C(=S)S1)CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCC/C(=C\1/C(=O)N(C(=S)S1)CC(=O)O)/C2=CC=CC=C2

InChI

InChI=1S/C29H43NO3S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(24-20-17-16-18-21-24)27-28(33)30(23-26(31)32)29(34)35-27/h16-18,20-21H,2-15,19,22-23H2,1H3,(H,31,32)/b27-25+