Compound C12H20ClN5O2S

dimethyl-[2-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)sulfanylethyl]azanium chloride

CAS: 24851-37-4

Molecular Formula	`C12H20ClN5O2S`
Molecular Weight	333.84 g/mol
Topological Polar Surface Area	88.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	333.10263
Heavy Atoms	21
Complexity	405.0

Chemical Identifiers

CAS Number	24851-37-4
SMILES	`CN1C2=C(N=C1SCC[NH+](C)C)N(C(=O)N(C2=O)C)C.[Cl-]`
InChIKey	`WBLULWILRWOFRZ-UHFFFAOYSA-N`

📖 Product Overview

Compound C12H20ClN5O2S (CAS: 24851-37-4) is a chemical compound with molecular formula C12H20ClN5O2S and molecular weight 333.84 g/mol. Its IUPAC systematic name is dimethyl-[2-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)sulfanylethyl]azanium chloride. Topological Polar Surface Area 88.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 333.10263 Heavy Atoms 21 Complexity 405.0 InChI Key: WBLULWILRWOFRZ-UHFFFAOYSA-N. SMILES: CN1C2=C(N=C1SCC[NH+](C)C)N(C(=O)N(C2=O)C)C.[Cl-].

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