Home Aminos 2-(ethylamino)-2-(pyridin-3-yl)ethanethioamide dihydrochloride

2-(ethylamino)-2-(pyridin-3-yl)ethanethioamide dihydrochloride

CAS No.:
1269151-46-3
Catalog Number:
AG01AGPD
Molecular Formula:
C9H15Cl2N3S
Molecular Weight:
268.2065
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Product Description
Catalog Number:
AG01AGPD
Chemical Name:
2-(ethylamino)-2-(pyridin-3-yl)ethanethioamide dihydrochloride
CAS Number:
1269151-46-3
Molecular Formula:
C9H15Cl2N3S
Molecular Weight:
268.2065
MDL Number:
MFCD18380617
IUPAC Name:
2-(ethylamino)-2-pyridin-3-ylethanethioamide;dihydrochloride
InChI:
InChI=1S/C9H13N3S.2ClH/c1-2-12-8(9(10)13)7-4-3-5-11-6-7;;/h3-6,8,12H,2H2,1H3,(H2,10,13);2*1H
InChI Key:
OHJVZUSMEUMLCV-UHFFFAOYSA-N
SMILES:
CCNC(c1cccnc1)C(=S)N.Cl.Cl
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.036g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
268.2g/mol
Monoisotopic Mass:
267.036g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties