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Home > Sulfanilamide > 1718-39-4
1718-39-4 | 4-THIOUREIDO-BENZENESULFONAMIDE
CAS No: 1718-39-4 Catalog No: AG00APEZ MDL No:MFCD00775046
Product Description
Catalog Number:
AG00APEZ
Chemical Name:
4-THIOUREIDO-BENZENESULFONAMIDE
CAS Number:
1718-39-4
Molecular Formula:
C7H9N3O2S2
Molecular Weight:
231.2953
MDL Number:
MFCD00775046
IUPAC Name:
(4-sulfamoylphenyl)thiourea
InChI:
InChI=1S/C7H9N3O2S2/c8-7(13)10-5-1-3-6(4-2-5)14(9,11)12/h1-4H,(H3,8,10,13)(H2,9,11,12)
InChI Key:
OGAAVFJBPHTLNL-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1ccc(cc1)S(=O)(=O)N
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.014g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
231.288g/mol
Monoisotopic Mass:
231.014g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
139A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Carbonic anhydrase inhibitors: inhibition of Plasmodium falciparum carbonic anhydrase with aromatic/heterocyclic sulfonamides-in vitro and in vivo studies. | Bioorganic & medicinal chemistry letters 20081015 |
| Carbonic anhydrase inhibitors: the first on-resin screening of a 4-sulfamoylphenylthiourea library. | Journal of medicinal chemistry 20041007 |
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