3-[[4-[(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[4-[(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Openeye Name: 3-[[4-[(4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid CAS Name: 3-[[4-[(4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]phenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Traditional Name: 3-[[4-[(4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Formula: C18H13NO4S2 MolecularWeight: 371.43012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC2=CC=C(C=C2)C=C3C(=O)NC(=S)S3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)COC2=CC=C(C=C2)C=C3C(=O)NC(=S)S3)C(=O)O

InChI

InChI=1S/C18H13NO4S2/c20-16-15(25-18(24)19-16)9-11-4-6-14(7-5-11)23-10-12-2-1-3-13(8-12)17(21)22/h1-9H,10H2,(H,21,22)(H,19,20,24)