4-[5-(4-benzamidobutyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Systemtic Name: 4-[5-(4-benzamidobutyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Openeye Name: 4-[5-(4-benzamidobutyl)-4-oxo-2-thioxo-thiazolidin-3-yl]butanoic acid CAS Name: 4-[5-(4-benzamidobutyl)-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid IUPAC Name: 4-[5-(4-benzamidobutyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Traditional Name: 4-[5-(4-benzamidobutyl)-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCCCC2C(=O)N(C(=S)S2)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCCCC2C(=O)N(C(=S)S2)CCCC(=O)O

InChI

InChI=1S/C18H22N2O4S2/c21-15(22)10-6-12-20-17(24)14(26-18(20)25)9-4-5-11-19-16(23)13-7-2-1-3-8-13/h1-3,7-8,14H,4-6,9-12H2,(H,19,23)(H,21,22)