4-chloranyl-3-[[(E)-(4-oxidanylidene-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]amino]benzoic acid

Systemtic Name: 4-chloranyl-3-[[(E)-(4-oxidanylidene-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]amino]benzoic acid Openeye Name: 4-chloro-3-[[(E)-(4-oxo-3-propyl-2-thioxo-thiazolidin-5-ylidene)methyl]amino]benzoic acid CAS Name: 4-chloro-3-[[(E)-(4-oxo-3-propyl-2-sulfanylidene-5-thiazolidinylidene)methyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[[(E)-(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]amino]benzoic acid Traditional Name: 4-chloro-3-[[(E)-(4-keto-3-propyl-2-thioxo-thiazolidin-5-ylidene)methyl]amino]benzoic acid Formula: C14H13ClN2O3S2 MolecularWeight: 356.84762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CNC2=C(C=CC(=C2)C(=O)O)Cl)SC1=S

Isomeric SMILES

CCCN1C(=O)/C(=C\NC2=C(C=CC(=C2)C(=O)O)Cl)/SC1=S

InChI

InChI=1S/C14H13ClN2O3S2/c1-2-5-17-12(18)11(22-14(17)21)7-16-10-6-8(13(19)20)3-4-9(10)15/h3-4,6-7,16H,2,5H2,1H3,(H,19,20)/b11-7+