LRF

N~2~-(4-cyano-3-methyl-1,2-thiazol-5-yl)-N~2~-methylglycinamide

Created: 2022-03-04
Last modified:  2022-03-16

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Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count24
Aromatic Bond Count5
2D diagram of LRF

Chemical Component Summary

NameN~2~-(4-cyano-3-methyl-1,2-thiazol-5-yl)-N~2~-methylglycinamide
Systematic Name (OpenEye OEToolkits)2-[(4-cyano-3-methyl-1,2-thiazol-5-yl)-methyl-amino]ethanamide
FormulaC8 H10 N4 O S
Molecular Weight210.256
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01N#Cc1c(snc1C)N(C)CC(N)=O
SMILESCACTVS3.385CN(CC(N)=O)c1snc(C)c1C#N
SMILESOpenEye OEToolkits2.0.7Cc1c(c(sn1)N(C)CC(=O)N)C#N
Canonical SMILESCACTVS3.385 CN(CC(N)=O)c1snc(C)c1C#N
Canonical SMILESOpenEye OEToolkits2.0.7 Cc1c(c(sn1)N(C)CC(=O)N)C#N
InChIInChI1.03 InChI=1S/C8H10N4OS/c1-5-6(3-9)8(14-11-5)12(2)4-7(10)13/h4H2,1-2H3,(H2,10,13)
InChIKeyInChI1.03 BCFQGXBWVPWHCV-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 121557884