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Acetamide, N,N'-1,2-ethanediylbis(2-((2-propenylamino)thioxomethyl)amino)-

HCID 3086767
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Basic information

CAS
111915-68-5
Standard SMILES
C=CCNC(=S)NCC(=O)NCCNC(=O)CNC(=S)NCC=C
InChIKey
UGJUXDJTGCBMHX-UHFFFAOYSA-N
Molecular formula
C14H24N6O2S2
Average molar mass
372.5 g/mol
Monoisotopic mass
372.14021638

Names & identifiers

Preferred name
Acetamide, N,N'-1,2-ethanediylbis(2-((2-propenylamino)thioxomethyl)amino)-
IUPAC
2-(prop-2-enylcarbamothioylamino)-N-[2-[[2-(prop-2-enylcarbamothioylamino)acetyl]amino]ethyl]acetamide

Names & synonyms

BRN 5625541N,N'-Bis(allylthiocarbamoylglycyl)ethylenediamine111915-68-5Acetamide, N,N'-1,2-ethanediylbis(2-((2-propenylamino)thioxomethyl)amino)-N,N'-1,2-Ethanediylbis(2-((2-propenylamino)thioxomethyl)amino)acetamideDTXSID60149782RefChem:314780DTXCID0072273AKOS024367509ST51001448N,N'-(Ethane-1,2-diyl)bis(2-{[(prop-2-en-1-yl)carbamothioyl]amino}acetamide)2-{[(prop-2-enylamino)thioxomethyl]amino}-N-[2-(2-{[(prop-2-enylamino)thioxome thyl]amino}acetylamino)ethyl]acetamide

Database identifiers

CAS
111915-68-5
PubChem CID
3086767
DTXSID
DTXSID60149782

Properties

Computed structural properties

XLogP
-0.3
Topological polar surface area
171 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
24
Formal charge
0
Complexity
428

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