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101651-61-0 | Acetamide, N-(2-chlorophenyl)-2-[[2-(diethylamino)ethyl]thio]-, hydrochloride (1:1)
CAS No: 101651-61-0 Catalog No: AG000528 MDL No:
Product Description
Catalog Number:
AG000528
Chemical Name:
Acetamide, N-(2-chlorophenyl)-2-[[2-(diethylamino)ethyl]thio]-, hydrochloride (1:1)
CAS Number:
101651-61-0
Molecular Formula:
C14H22Cl2N2OS
Molecular Weight:
337.3083
IUPAC Name:
2-[2-(2-chloroanilino)-2-oxoethyl]sulfanylethyl-diethylazanium;chloride
InChI:
InChI=1S/C14H21ClN2OS.ClH/c1-3-17(4-2)9-10-19-11-14(18)16-13-8-6-5-7-12(13)15;/h5-8H,3-4,9-11H2,1-2H3,(H,16,18);1H
InChI Key:
AKCGZYLVQIZGMO-UHFFFAOYSA-N
SMILES:
CCN(CCSCC(=O)Nc1ccccc1Cl)CC.Cl
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.083g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
337.303g/mol
Monoisotopic Mass:
336.083g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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