GWY

5-chloranyl-~{N}-methyl-~{N}-[[(3~{S})-oxolan-3-yl]methyl]pyrimidin-4-amine

Created:2018-06-01
Last modified:  2018-07-18

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Chemical Details

Formal Charge0
Atom Count29
Chiral Atom Count1
Bond Count30
Aromatic Bond Count6
2D diagram of GWY

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Chemical Component Summary

Name5-chloranyl-~{N}-methyl-~{N}-[[(3~{S})-oxolan-3-yl]methyl]pyrimidin-4-amine
Systematic Name (OpenEye OEToolkits)5-chloranyl-~{N}-methyl-~{N}-[[(3~{S})-oxolan-3-yl]methyl]pyrimidin-4-amine
FormulaC10 H14 Cl N3 O
Molecular Weight227.691
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385CN(C[CH]1CCOC1)c2ncncc2Cl
SMILESOpenEye OEToolkits2.0.6CN(CC1CCOC1)c2c(cncn2)Cl
Canonical SMILESCACTVS3.385 CN(C[C@@H]1CCOC1)c2ncncc2Cl
Canonical SMILESOpenEye OEToolkits2.0.6 CN(C[C@@H]1CCOC1)c2c(cncn2)Cl
InChIInChI1.03 InChI=1S/C10H14ClN3O/c1-14(5-8-2-3-15-6-8)10-9(11)4-12-7-13-10/h4,7-8H,2-3,5-6H2,1H3/t8-/m0/s1
InChIKeyInChI1.03 OYKZBUOZAYBEHE-QMMMGPOBSA-N

Related Resource References

Resource NameReference
PubChem 97841134