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Home > Pyridines > 730973-42-9
730973-42-9 | 4,5,6-trimethyl-2-sulfanylpyridine-3-carboxamide
CAS No: 730973-42-9 Catalog No: AG019O4T MDL No:MFCD06655481
Product Description
Catalog Number:
AG019O4T
Chemical Name:
4,5,6-trimethyl-2-sulfanylpyridine-3-carboxamide
CAS Number:
730973-42-9
Molecular Formula:
C9H12N2OS
Molecular Weight:
196.2694
MDL Number:
MFCD06655481
IUPAC Name:
4,5,6-trimethyl-2-sulfanylidene-1H-pyridine-3-carboxamide
InChI:
InChI=1S/C9H12N2OS/c1-4-5(2)7(8(10)12)9(13)11-6(4)3/h1-3H3,(H2,10,12)(H,11,13)
InChI Key:
NJGPDJBFPDFXNN-UHFFFAOYSA-N
SMILES:
NC(=O)c1c(S)nc(c(c1C)C)C
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.268g/mol
Monoisotopic Mass:
196.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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