N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide

C6H8N4O2S2 — CID 108782821

IUPACN-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide
SMILESCc1csc2nc(NS(C)(=O)=O)nn12
InChIInChI=1S/C6H8N4O2S2/c1-4-3-13-6-7-5(8-10(4)6)9-14(2,11)12/h3H,1-2H3,(H,8,9)
InChIKeyCHYVIQCIPUAEKB-UHFFFAOYSA-N
MW232.29 g/mol
LogP0.47
Rot. Bonds2

About N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide

N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide (PubChem CID 108782821) has the molecular formula C6H8N4O2S2 and a molecular weight of 232.29 g/mol. Its IUPAC name is N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide
PubChem CID108782821
Molecular FormulaC6H8N4O2S2
Molecular Weight232.29 g/mol
Exact Mass232.01
IUPAC NameN-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide
SMILESCc1csc2nc(NS(C)(=O)=O)nn12
InChIInChI=1S/C6H8N4O2S2/c1-4-3-13-6-7-5(8-10(4)6)9-14(2,11)12/h3H,1-2H3,(H,8,9)
InChIKeyCHYVIQCIPUAEKB-UHFFFAOYSA-N
XLogP0.47
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,2,2-trifluoro-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)acetamide
CID 108763051
6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
CID 733193
4-chloro-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)benzamide
CID 108763069
3,4-dimethyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)benzamide
CID 108740491
4-methoxy-N-[6-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]benzenesulfonamide
CID 108780595
N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)benzenesulfonamide
CID 108780564
2-(1,3-dioxoisoindol-2-yl)-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide
CID 108763094
N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)-4-oxo-4-thiophen-2-ylbutanamide
CID 108740560
N-[6-(4-methoxyphenyl)pyridazin-3-yl]-6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
CID 108776575
2,4-dimethyl-N-[6-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]benzenesulfonamide
CID 108780603
N-(5-benzyl-2,6-dimethylpyrimidin-4-yl)-6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
CID 108776567
N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)butane-1-sulfonamide
CID 108780563

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide?
The IUPAC name of N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide (CID 108782821) is N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide.
What is the SMILES notation for N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide?
The canonical SMILES for N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide is Cc1csc2nc(NS(C)(=O)=O)nn12.
What is the InChIKey of N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide?
The InChIKey is CHYVIQCIPUAEKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O2S2/c1-4-3-13-6-7-5(8-10(4)6)9-14(2,11)12/h3H,1-2H3,(H,8,9).
What are the key properties of N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide?
N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide has a molecular weight of 232.29 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanesulfonamide is sourced from PubChem (CID 108782821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).