3-[2-(3-methyl-2-sulfanylidene-imidazolidin-1-yl)ethoxycarbonyl]but-3-enoic acid

Systemtic Name: 3-[2-(3-methyl-2-sulfanylidene-imidazolidin-1-yl)ethoxycarbonyl]but-3-enoic acid Openeye Name: 3-[2-(3-methyl-2-thioxo-imidazolidin-1-yl)ethoxycarbonyl]but-3-enoic acid CAS Name: 3-[2-(3-methyl-2-sulfanylidene-1-imidazolidinyl)ethoxy-oxomethyl]-3-butenoic acid IUPAC Name: 3-[2-(3-methyl-2-sulfanylideneimidazolidin-1-yl)ethoxycarbonyl]but-3-enoic acid Traditional Name: 3-[2-(3-methyl-2-thioxo-imidazolidin-1-yl)ethoxycarbonyl]but-3-enoic acid Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C1=S)CCOC(=O)C(=C)CC(=O)O

Isomeric SMILES

CN1CCN(C1=S)CCOC(=O)C(=C)CC(=O)O

InChI

InChI=1S/C11H16N2O4S/c1-8(7-9(14)15)10(16)17-6-5-13-4-3-12(2)11(13)18/h1,3-7H2,2H3,(H,14,15)