S8P

5-methyl-~{N}-[[(2~{S})-oxolan-2-yl]methyl]-1,2-thiazole-3-carboxamide

Created: 2020-03-05
Last modified:  2020-04-22

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Chemical Details

Formal Charge0
Atom Count29
Chiral Atom Count1
Bond Count30
Aromatic Bond Count5
2D diagram of S8P

Chemical Component Summary

Name5-methyl-~{N}-[[(2~{S})-oxolan-2-yl]methyl]-1,2-thiazole-3-carboxamide
Systematic Name (OpenEye OEToolkits)5-methyl-~{N}-[[(2~{S})-oxolan-2-yl]methyl]-1,2-thiazole-3-carboxamide
FormulaC10 H14 N2 O2 S
Molecular Weight226.295
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385Cc1snc(c1)C(=O)NC[CH]2CCCO2
SMILESOpenEye OEToolkits2.0.6Cc1cc(ns1)C(=O)NCC2CCCO2
Canonical SMILESCACTVS3.385 Cc1snc(c1)C(=O)NC[C@@H]2CCCO2
Canonical SMILESOpenEye OEToolkits2.0.6 Cc1cc(ns1)C(=O)NC[C@@H]2CCCO2
InChIInChI1.03 InChI=1S/C10H14N2O2S/c1-7-5-9(12-15-7)10(13)11-6-8-3-2-4-14-8/h5,8H,2-4,6H2,1H3,(H,11,13)/t8-/m0/s1
InChIKeyInChI1.03 PYHOSVJXCWPVCG-QMMMGPOBSA-N

Related Resource References

Resource NameReference
PubChem 97645999