4-[5-[[3-[(4-chlorophenyl)methoxy]phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Systemtic Name: 4-[5-[[3-[(4-chlorophenyl)methoxy]phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Openeye Name: 4-[5-[[3-[(4-chlorophenyl)methoxy]phenyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoic acid CAS Name: 4-[5-[[3-[(4-chlorophenyl)methoxy]phenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid IUPAC Name: 4-[5-[[3-[(4-chlorophenyl)methoxy]phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Traditional Name: 4-[5-[3-(4-chlorobenzyl)oxybenzylidene]-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid Formula: C21H18ClNO4S2 MolecularWeight: 447.95492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=CC=C(C=C2)Cl)C=C3C(=O)N(C(=S)S3)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=CC=C(C=C2)Cl)C=C3C(=O)N(C(=S)S3)CCCC(=O)O

InChI

InChI=1S/C21H18ClNO4S2/c22-16-8-6-14(7-9-16)13-27-17-4-1-3-15(11-17)12-18-20(26)23(21(28)29-18)10-2-5-19(24)25/h1,3-4,6-9,11-12H,2,5,10,13H2,(H,24,25)