2-[2-(1-benzothiophen-2-ylsulfonylamino)ethylamino]ethanoic acid

Systemtic Name: 2-[2-(1-benzothiophen-2-ylsulfonylamino)ethylamino]ethanoic acid Openeye Name: 2-[2-(benzothiophen-2-ylsulfonylamino)ethylamino]acetic acid CAS Name: 2-[2-(1-benzothiophen-2-ylsulfonylamino)ethylamino]acetic acid IUPAC Name: 2-[2-(1-benzothiophen-2-ylsulfonylamino)ethylamino]acetic acid Traditional Name: 2-[2-(benzothiophen-2-ylsulfonylamino)ethylamino]acetic acid Formula: C12H14N2O4S2 MolecularWeight: 314.38056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)S(=O)(=O)NCCNCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)S(=O)(=O)NCCNCC(=O)O

InChI

InChI=1S/C12H14N2O4S2/c15-11(16)8-13-5-6-14-20(17,18)12-7-9-3-1-2-4-10(9)19-12/h1-4,7,13-14H,5-6,8H2,(H,15,16)