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bensultap

Structure via PubChem · Public domain (PubChem)

EntityQ818194· pop 5

bensultap

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Also known as nereistoxin dibenzenesulfonate, S,S'-(2-(dimethylamino)trimethylene)bis(benzenethiosulfonate), S,S'-2-dimethylaminotrimethylene di(benzenethiosulfonate), S,S'-2-dimethylaminotrimethylene di(benzenethiosulphonate), thiobenzenesulfonic acid S,S'-(2-(dimethylamino)trimethylene) ester, S,S'-(2-(dimethylamino)-1,3-propanediyl)dibenzenesulfothioate

chemical compound

Chemical data

Formula: C17H21NO4S4
Molecular weight: 431.6 g/mol
IUPAC name: 1,3-bis(benzenesulfonylsulfanyl)-N,N-dimethylpropan-2-amine
SMILES: CN(C)C(CSS(=O)(=O)C1=CC=CC=C1)CSS(=O)(=O)C2=CC=CC=C2
InChIKey: YFXPPSKYMBTNAV-UHFFFAOYSA-N
XLogP: 3.4
Polar surface area: 139 Å²
H-bond donors: 0
H-bond acceptors: 7
Formal charge: 0

via PubChem

Drug data · ChEMBL

Molecule type: Small molecule

via ChEMBL · EBI

Wikidata facts

Subclass of: chemical compound
Mass: 431.035

Show 3 more facts

chemical formula: C₁₇H₂₁NO₄S₄
canonical SMILES: CN(C)C(CSS(=O)(=O)C1=CC=CC=C1)CSS(=O)(=O)C2=CC=CC=C2
Commons category: Bensultap

Sources (3)

via Wikidata · CC0

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via Wikidata sitelinks · CC0