4-[[4-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl]carbonylamino]butanoate

Systemtic Name: 4-[[4-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl]carbonylamino]butanoate Openeye Name: 4-[[4-[(E)-(3-methyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]benzoyl]amino]butanoate CAS Name: 4-[[[4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl]-oxomethyl]amino]butanoate IUPAC Name: 4-[[4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoyl]amino]butanoate Traditional Name: 4-[[4-[(E)-(4-keto-3-methyl-2-thioxo-thiazolidin-5-ylidene)methyl]benzoyl]amino]butyrate Formula: C16H15N2O4S2- MolecularWeight: 363.4313

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=C(C=C2)C(=O)NCCCC(=O)[O-])SC1=S

Isomeric SMILES

CN1C(=O)/C(=C\C2=CC=C(C=C2)C(=O)NCCCC(=O)[O-])/SC1=S

InChI

InChI=1S/C16H16N2O4S2/c1-18-15(22)12(24-16(18)23)9-10-4-6-11(7-5-10)14(21)17-8-2-3-13(19)20/h4-7,9H,2-3,8H2,1H3,(H,17,21)(H,19,20)/p-1/b12-9+