Methyl N-[[[[[(diethoxyphosphinothioyl)isopropylamino]sulfinyl]methylamino]carbonyl]oxy]ethanimidothioate

HCID 86739075
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Basic information

Standard SMILES
CCOP(=S)(OCC)N(C(C)C)S(=O)CNC(=O)ON=C(C)SC
InChIKey
ZSPWXTOXSJERBJ-UHFFFAOYSA-N
Molecular formula
C12H26N3O5PS3
Average molar mass
419.5 g/mol

Names & identifiers

Preferred name
Methyl N-[[[[[(diethoxyphosphinothioyl)isopropylamino]sulfinyl]methylamino]carbonyl]oxy]ethanimidothioate
IUPAC
methyl N-[[diethoxyphosphinothioyl(propan-2-yl)sulfinamoyl]methylcarbamoyloxy]ethanimidothioate

Names & synonyms

SCHEMBL11134949ZSPWXTOXSJERBJ-UHFFFAOYSA-NMethyl N-[[[[[(diethoxyphosphinothioyl)isopropylamino]sulfinyl]methylamino]carbonyl]oxy]ethanimidothioate

Database identifiers

PubChem CID
86739075

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
166 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
10
Rotatable bonds
12
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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