2-[(5E)-5-[(2Z)-2-(3-ethyl-4-methyl-5-propanoyloxy-1,3-thiazol-2-ylidene)ethylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid

Systemtic Name: 2-[(5E)-5-[(2Z)-2-(3-ethyl-4-methyl-5-propanoyloxy-1,3-thiazol-2-ylidene)ethylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid Openeye Name: 2-[(5E)-5-[(2Z)-2-(3-ethyl-4-methyl-5-propanoyloxy-thiazol-2-ylidene)ethylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetic acid CAS Name: 2-[(5E)-5-[(2Z)-2-[3-ethyl-4-methyl-5-(1-oxopropoxy)-2-thiazolylidene]ethylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid IUPAC Name: 2-[(5E)-5-[(2Z)-2-(3-ethyl-4-methyl-5-propanoyloxy-1,3-thiazol-2-ylidene)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid Traditional Name: 2-[(5E)-5-[(2Z)-2-(3-ethyl-4-methyl-5-propionyloxy-4-thiazolin-2-ylidene)ethylidene]-4-keto-2-thioxo-thiazolidin-3-yl]acetic acid Formula: C16H18N2O5S3 MolecularWeight: 414.51952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(N(C(=CC=C2C(=O)N(C(=S)S2)CC(=O)O)S1)CC)C

Isomeric SMILES

CCC(=O)OC1=C(N(/C(=C/C=C/2\C(=O)N(C(=S)S2)CC(=O)O)/S1)CC)C

InChI

InChI=1S/C16H18N2O5S3/c1-4-13(21)23-15-9(3)17(5-2)11(26-15)7-6-10-14(22)18(8-12(19)20)16(24)25-10/h6-7H,4-5,8H2,1-3H3,(H,19,20)/b10-6+,11-7-