Compound C11H18ClN5OS2

6-(1,4-dithia-8-azoniaspiro[4.5]decan-8-yl)-3-hydroxy-2-iminopyrimidin-4-amine chloride

CAS: 83546-47-8

Molecular Formula	`C11H18ClN5OS2`
Molecular Weight	335.9 g/mol
Topological Polar Surface Area	141.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	6
Rotatable Bonds	1
Exact Mass	335.06412
Heavy Atoms	20
Complexity	448.0

Chemical Identifiers

CAS Number	83546-47-8
SMILES	`C1C[NH+](CCC12SCCS2)C3=NC(=N)N(C(=C3)N)O.[Cl-]`
InChIKey	`FNBAFXCMPBYMLN-UHFFFAOYSA-N`

📖 Product Overview

Compound C11H18ClN5OS2 (CAS: 83546-47-8) is a chemical compound with molecular formula C11H18ClN5OS2 and molecular weight 335.9 g/mol. Its IUPAC systematic name is 6-(1,4-dithia-8-azoniaspiro[4.5]decan-8-yl)-3-hydroxy-2-iminopyrimidin-4-amine chloride. Topological Polar Surface Area 141.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 6 Rotatable Bonds 1 Exact Mass 335.06412 Heavy Atoms 20 Complexity 448.0 InChI Key: FNBAFXCMPBYMLN-UHFFFAOYSA-N. SMILES: C1C[NH+](CCC12SCCS2)C3=NC(=N)N(C(=C3)N)O.[Cl-].

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