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83711-61-9 | Acetamide,N-acetyl-N-(4-oxo-2-thioxo-5-thiazolidinyl)-
CAS No: 83711-61-9 Catalog No: AG008IHV MDL No:
Product Description
Catalog Number:
AG008IHV
Chemical Name:
Acetamide,N-acetyl-N-(4-oxo-2-thioxo-5-thiazolidinyl)-
CAS Number:
83711-61-9
Molecular Formula:
C7H8N2O3S2
Molecular Weight:
232.2800
IUPAC Name:
N-acetyl-N-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl)acetamide
InChI:
InChI=1S/C7H8N2O3S2/c1-3(10)9(4(2)11)6-5(12)8-7(13)14-6/h6H,1-2H3,(H,8,12,13)
InChI Key:
ILYHJTNWSDVJNA-UHFFFAOYSA-N
SMILES:
CC(=O)N(C1SC(=S)NC1=O)C(=O)C
EC Number:
280-559-7
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.998g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.272g/mol
Monoisotopic Mass:
231.998g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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