O,S-dimethyl N-(N'-propoxycarbonyl-N'-isopropylaminosulfenyl)phosphoramidothioate

HCID 12922684
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Basic information

Standard SMILES
CCCOC(=O)N(SNP(=O)(OC)SC)C(C)C
InChIKey
SCKFAQLKQRWXTL-UHFFFAOYSA-N
Molecular formula
C9H21N2O4PS2
Average molar mass
316.4 g/mol

Names & identifiers

Preferred name
O,S-dimethyl N-(N'-propoxycarbonyl-N'-isopropylaminosulfenyl)phosphoramidothioate
IUPAC
propyl N-[[methoxy(methylsulfanyl)phosphoryl]amino]sulfanyl-N-propan-2-ylcarbamate

Names & synonyms

SCHEMBL11317204SCKFAQLKQRWXTL-UHFFFAOYSA-NO,S-dimethyl N-(N'-propoxycarbonyl-N'-isopropylaminosulfenyl)phosphoramidothioate

Database identifiers

PubChem CID
12922684

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
118 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
18

Related reactions

1 records
New reaction record

Compound notes

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