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3683-36-1 | N-methyl-2-(pyridin-3-ylcarbonyl)hydrazinecarbothioamide
CAS No: 3683-36-1 Catalog No: AG00JGZS MDL No:MFCD00275309
Product Description
Catalog Number:
AG00JGZS
Chemical Name:
N-methyl-2-(pyridin-3-ylcarbonyl)hydrazinecarbothioamide
CAS Number:
3683-36-1
Molecular Formula:
C8H10N4OS
Molecular Weight:
210.2562
MDL Number:
MFCD00275309
IUPAC Name:
1-methyl-3-(pyridine-3-carbonylamino)thiourea
InChI:
InChI=1S/C8H10N4OS/c1-9-8(14)12-11-7(13)6-3-2-4-10-5-6/h2-5H,1H3,(H,11,13)(H2,9,12,14)
InChI Key:
DUIDMCFMTLDCHQ-UHFFFAOYSA-N
SMILES:
CNC(=S)NNC(=O)c1cccnc1
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
210.255g/mol
Monoisotopic Mass:
210.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
98.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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