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89730-85-8 | Acetamide, N-[3-methyl-5-(methylthio)-1,2,4-triazin-6-yl]-
CAS No: 89730-85-8 Catalog No: AG0041XG MDL No:
Product Description
Catalog Number:
AG0041XG
Chemical Name:
Acetamide, N-[3-methyl-5-(methylthio)-1,2,4-triazin-6-yl]-
CAS Number:
89730-85-8
Molecular Formula:
C7H10N4OS
Molecular Weight:
198.2455
IUPAC Name:
N-(3-methyl-5-methylsulfanyl-1,2,4-triazin-6-yl)acetamide
InChI:
InChI=1S/C7H10N4OS/c1-4-8-7(13-3)6(11-10-4)9-5(2)12/h1-3H3,(H,9,11,12)
InChI Key:
WFVQVKPDICFXFI-UHFFFAOYSA-N
SMILES:
CSc1nc(C)nnc1NC(=O)C
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.244g/mol
Monoisotopic Mass:
198.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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