2-(2-imidazol-1-ylethyl)-4,5-dihydro-1-benzothiophene-6-carboxylic acid

Systemtic Name: 2-(2-imidazol-1-ylethyl)-4,5-dihydro-1-benzothiophene-6-carboxylic acid Openeye Name: 2-(2-imidazol-1-ylethyl)-4,5-dihydrobenzothiophene-6-carboxylic acid CAS Name: 2-[2-(1-imidazolyl)ethyl]-4,5-dihydro-1-benzothiophene-6-carboxylic acid IUPAC Name: 2-(2-imidazol-1-ylethyl)-4,5-dihydro-1-benzothiophene-6-carboxylic acid Traditional Name: 2-(2-imidazol-1-ylethyl)-4,5-dihydrobenzothiophene-6-carboxylic acid Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C1C(=O)O)SC(=C2)CCN3C=CN=C3

Isomeric SMILES

C1CC2=C(C=C1C(=O)O)SC(=C2)CCN3C=CN=C3

InChI

InChI=1S/C14H14N2O2S/c17-14(18)11-2-1-10-7-12(19-13(10)8-11)3-5-16-6-4-15-9-16/h4,6-9H,1-3,5H2,(H,17,18)