11-[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid

Systemtic Name: 11-[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid Openeye Name: 11-[(5Z)-5-(2H-chromen-3-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]undecanoic acid CAS Name: 11-[(5Z)-5-(2H-1-benzopyran-3-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]undecanoic acid IUPAC Name: 11-[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid Traditional Name: 11-[(5Z)-5-(2H-chromen-3-ylmethylene)-4-keto-2-thioxo-thiazolidin-3-yl]undecanoic acid Formula: C24H29NO4S2 MolecularWeight: 459.62136

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=CC=C2O1)C=C3C(=O)N(C(=S)S3)CCCCCCCCCCC(=O)O

Isomeric SMILES

C1C(=CC2=CC=CC=C2O1)/C=C\3/C(=O)N(C(=S)S3)CCCCCCCCCCC(=O)O

InChI

InChI=1S/C24H29NO4S2/c26-22(27)13-7-5-3-1-2-4-6-10-14-25-23(28)21(31-24(25)30)16-18-15-19-11-8-9-12-20(19)29-17-18/h8-9,11-12,15-16H,1-7,10,13-14,17H2,(H,26,27)/b21-16-