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2950-35-8 | 4-Thiazolidinone, 5-[(dimethylamino)methylene]-3-ethyl-2-thioxo-
CAS No: 2950-35-8 Catalog No: AG002YL1 MDL No:
Product Description
Catalog Number:
AG002YL1
Chemical Name:
4-Thiazolidinone, 5-[(dimethylamino)methylene]-3-ethyl-2-thioxo-
CAS Number:
2950-35-8
Molecular Formula:
C8H12N2OS2
Molecular Weight:
216.3237
IUPAC Name:
5-(dimethylaminomethylidene)-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C8H12N2OS2/c1-4-10-7(11)6(5-9(2)3)13-8(10)12/h5H,4H2,1-3H3
InChI Key:
RQAKTNCDTMXFHS-UHFFFAOYSA-N
SMILES:
CCN1C(=S)SC(=CN(C)C)C1=O
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.039g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.317g/mol
Monoisotopic Mass:
216.039g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.6
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