N-(4-Aminobenzenesulfonyl) Sulfamethoxazole (CHEBI:201567)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	N-(4-Aminobenzenesulfonyl) Sulfamethoxazole

ChEBI ID	CHEBI:201567

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H16N4O5S2

Net Charge

Average Mass

408.450

Monoisotopic Mass

408.05621

InChI

InChI=1S/C16H16N4O5S2/c1-11-10-16(18-25-11)20-27(23,24)15-8-4-13(5-9-15)19-26(21,22)14-6-2-12(17)3-7-14/h2-10,19H,17H2,1H3,(H,18,20)

InChIKey

ULRBBWWPWOJYFE-UHFFFAOYSA-N

SMILES

S(=O)(=O)(NC1=CC=C(S(=O)(=O)NC2=NOC(=C2)C)C=C1)C3=CC=C(N)C=C3

ChEBI Ontology
Outgoing	N-(4-Aminobenzenesulfonyl) Sulfamethoxazole (CHEBI:201567) is a benzenes (CHEBI:22712) N-(4-Aminobenzenesulfonyl) Sulfamethoxazole (CHEBI:201567) is a sulfonamide (CHEBI:35358)

IUPAC Name

4-amino-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulamoyl]phenyl]benzenesulonamide