4-Bromo-3-[(2-aminoethyl)thiomethyl]isothiazole hydrobromide

HCID 20550098

Basic information

Standard SMILES
Br.NCCSCc1nscc1Br
InChIKey
USUHJTNMHJIVML-UHFFFAOYSA-N
Molecular formula
C6H10Br2N2S2
Average molar mass
334.1 g/mol

Names & identifiers

Preferred name
4-Bromo-3-[(2-aminoethyl)thiomethyl]isothiazole hydrobromide
IUPAC
2-[(4-bromo-1,2-thiazol-3-yl)methylsulfanyl]ethanamine;hydrobromide

Names & synonyms

SCHEMBL11231335USUHJTNMHJIVML-UHFFFAOYSA-N4-bromo-3-[(2-aminoethyl)thiomethyl]isothiazole hydrobromide4-bromo-3-[(2-aminoethyl)thiomethyyl]isothiazole hydrobromide4-bromo-3-[-(2-aminoethyl)thiomethyl]isothiazole hydrobromide

Database identifiers

PubChem CID
20550098

Properties

Computed structural properties

Topological polar surface area
92.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
12

Related reactions

47 records

Linked notes

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