4-[2-(5-ethoxycarbonylthiophen-2-yl)ethyl]-3-oxidanylidene-thiomorpholine-2-carboxylic acid

Systemtic Name: 4-[2-(5-ethoxycarbonylthiophen-2-yl)ethyl]-3-oxidanylidene-thiomorpholine-2-carboxylic acid Openeye Name: 4-[2-(5-ethoxycarbonyl-2-thienyl)ethyl]-3-oxo-thiomorpholine-2-carboxylic acid CAS Name: 4-[2-(5-ethoxycarbonyl-2-thiophenyl)ethyl]-3-oxo-2-thiomorpholinecarboxylic acid IUPAC Name: 4-[2-(5-ethoxycarbonylthiophen-2-yl)ethyl]-3-oxothiomorpholine-2-carboxylic acid Traditional Name: 4-[2-(5-carbethoxy-2-thienyl)ethyl]-3-keto-thiomorpholine-2-carboxylic acid Formula: C14H17NO5S2 MolecularWeight: 343.41848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(S1)CCN2CCSC(C2=O)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(S1)CCN2CCSC(C2=O)C(=O)O

InChI

InChI=1S/C14H17NO5S2/c1-2-20-14(19)10-4-3-9(22-10)5-6-15-7-8-21-11(12(15)16)13(17)18/h3-4,11H,2,5-8H2,1H3,(H,17,18)