2-oxidanylidene-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]-3H-1,3-benzothiazole-6-sulfonamide

Systemtic Name: 2-oxidanylidene-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]-3H-1,3-benzothiazole-6-sulfonamide Openeye Name: 2-oxo-N-[4-(thiazol-2-ylsulfamoyl)phenyl]-3H-1,3-benzothiazole-6-sulfonamide CAS Name: 2-oxo-N-[4-(2-thiazolylsulfamoyl)phenyl]-3H-1,3-benzothiazole-6-sulfonamide IUPAC Name: 2-oxo-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]-3H-1,3-benzothiazole-6-sulfonamide Traditional Name: 2-keto-N-[4-(thiazol-2-ylsulfamoyl)phenyl]-3H-1,3-benzothiazole-6-sulfonamide Formula: C16H12N4O5S4 MolecularWeight: 468.55028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)S3)S(=O)(=O)NC4=NC=CS4

Isomeric SMILES

C1=CC(=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)S3)S(=O)(=O)NC4=NC=CS4

InChI

InChI=1S/C16H12N4O5S4/c21-16-18-13-6-5-12(9-14(13)27-16)29(24,25)19-10-1-3-11(4-2-10)28(22,23)20-15-17-7-8-26-15/h1-9,19H,(H,17,20)(H,18,21)