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

Systemtic Name: phenyl-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino]methanesulfonic acid Openeye Name: phenyl-[4-(thiazol-2-ylsulfamoyl)anilino]methanesulfonic acid CAS Name: phenyl-[4-(2-thiazolylsulfamoyl)anilino]methanesulfonic acid IUPAC Name: phenyl-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]methanesulfonic acid Traditional Name: phenyl-[4-(thiazol-2-ylsulfamoyl)anilino]methanesulfonic acid Formula: C16H15N3O5S3 MolecularWeight: 425.5024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)S(=O)(=O)O

InChI

InChI=1S/C16H15N3O5S3/c20-26(21,19-16-17-10-11-25-16)14-8-6-13(7-9-14)18-15(27(22,23)24)12-4-2-1-3-5-12/h1-11,15,18H,(H,17,19)(H,22,23,24)