3-[(5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[(5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)thiazolidine-4-carboxylic acid CAS Name: 3-[(5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-(5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)thiazolidine-4-carboxylic acid Formula: C15H19NO3S2 MolecularWeight: 325.44626

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)N3CSCC3C(=O)O

Isomeric SMILES

CCC1CCC2=C(C1)C=C(S2)C(=O)N3CSCC3C(=O)O

InChI

InChI=1S/C15H19NO3S2/c1-2-9-3-4-12-10(5-9)6-13(21-12)14(17)16-8-20-7-11(16)15(18)19/h6,9,11H,2-5,7-8H2,1H3,(H,18,19)