3-(3,4-Dichloro-5-sulfamoylphenyl)-3-hydroxy-2,3,6,7-tetrahydro-5H-thiazolo[3,2-a]-pyrimidine-hydrochloride

HCID 21394725
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Basic information

Standard SMILES
Cl.NS(=O)(=O)c1cc(C2(O)CSC3=NCCCN32)cc(Cl)c1Cl
InChIKey
CEIPUJOKTYEDGT-UHFFFAOYSA-N
Molecular formula
C12H14Cl3N3O3S2
Average molar mass
418.7 g/mol
Monoisotopic mass
416.954217

Names & identifiers

Preferred name
3-(3,4-Dichloro-5-sulfamoylphenyl)-3-hydroxy-2,3,6,7-tetrahydro-5H-thiazolo[3,2-a]-pyrimidine-hydrochloride
IUPAC
2,3-dichloro-5-(3-hydroxy-2,5,6,7-tetrahydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)benzenesulfonamide;hydrochloride

Names & synonyms

SCHEMBL11762711CEIPUJOKTYEDGT-UHFFFAOYSA-N3-(3,4-Dichloro-5-sulfamoylphenyl)-3-hydroxy-2,3,6,7-tetrahydro-5H-thiazolo[3,2-a]-pyrimidine-hydrochloride

Database identifiers

PubChem CID
21394725

Properties

Computed structural properties

Topological polar surface area
130 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
23

Related reactions

1 records
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Compound notes

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