Name: Name:Benzenesulfonamide, N-(5-amino-1H-1,2,4-triazol-3-yl)- (9CI)
Brand: Angene
SKU: AG009K8Q
Rating: 90 (10 reviews)

Benzenesulfonamide, N-(5-amino-1H-1,2,4-triazol-3-yl)- (9CI)

CAS No.:

104667-72-3

Catalog Number:

AG009K8Q

Molecular Formula:

C8H9N5O2S

Molecular Weight:

239.2544

Catalog Number:

AG009K8Q

Chemical Name:

Benzenesulfonamide, N-(5-amino-1H-1,2,4-triazol-3-yl)- (9CI)

CAS Number:

104667-72-3

Molecular Formula:

C8H9N5O2S

Molecular Weight:

239.2544

MDL Number:

MFCD18825652

IUPAC Name:

N-(5-amino-1H-1,2,4-triazol-3-yl)benzenesulfonamide

InChI:

InChI=1S/C8H9N5O2S/c9-7-10-8(12-11-7)13-16(14,15)6-4-2-1-3-5-6/h1-5H,(H4,9,10,11,12,13)

InChI Key:

FNBSLOOXCPRTGY-UHFFFAOYSA-N

SMILES:

Nc1nnc([nH]1)NS(=O)(=O)c1ccccc1

Complexity:

322

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

239.048g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

239.253g/mol

Monoisotopic Mass:

239.048g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

122A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5