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

Systemtic Name: 3-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)thiazolidine-4-carboxylic acid CAS Name: 3-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)thiazolidine-4-carboxylic acid Formula: C14H17NO3S2 MolecularWeight: 311.41968

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N3CSCC3C(=O)O

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)N3CSCC3C(=O)O

InChI

InChI=1S/C14H17NO3S2/c1-8-2-3-11-9(4-8)5-12(20-11)13(16)15-7-19-6-10(15)14(17)18/h5,8,10H,2-4,6-7H2,1H3,(H,17,18)