2-[(5-cyano-1-benzothiophen-2-yl)sulfonylamino]ethanoic acid

Systemtic Name: 2-[(5-cyano-1-benzothiophen-2-yl)sulfonylamino]ethanoic acid Openeye Name: 2-[(5-cyanobenzothiophen-2-yl)sulfonylamino]acetic acid CAS Name: 2-[(5-cyano-1-benzothiophen-2-yl)sulfonylamino]acetic acid IUPAC Name: 2-[(5-cyano-1-benzothiophen-2-yl)sulfonylamino]acetic acid Traditional Name: 2-[(5-cyanobenzothiophen-2-yl)sulfonylamino]acetic acid Formula: C11H8N2O4S2 MolecularWeight: 296.32222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)C=C(S2)S(=O)(=O)NCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C#N)C=C(S2)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C11H8N2O4S2/c12-5-7-1-2-9-8(3-7)4-11(18-9)19(16,17)13-6-10(14)15/h1-4,13H,6H2,(H,14,15)