sodium 1-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino]ethanesulfonic acid

Systemtic Name: sodium 1-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino]ethanesulfonic acid Openeye Name: sodium 1-[4-(thiazol-2-ylsulfamoyl)anilino]ethanesulfonic acid CAS Name: sodium 1-[4-(2-thiazolylsulfamoyl)anilino]ethanesulfonic acid IUPAC Name: sodium 1-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]ethanesulfonic acid Traditional Name: sodium 1-[4-(thiazol-2-ylsulfamoyl)anilino]ethanesulfonic acid Formula: C11H13N3NaO5S3+ MolecularWeight: 386.42279

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CS2)S(=O)(=O)O.[Na+]

Isomeric SMILES

CC(NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CS2)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C11H13N3O5S3.Na/c1-8(22(17,18)19)13-9-2-4-10(5-3-9)21(15,16)14-11-12-6-7-20-11;/h2-8,13H,1H3,(H,12,14)(H,17,18,19);/q;+1