917

N-({(5S)-2-oxo-3-[4-(1,3-thiazol-5-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)acetamide

Created:2017-03-24
Last modified:  2021-03-01

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Chemical Details

Formal Charge0
Atom Count37
Chiral Atom Count1
Bond Count39
Aromatic Bond Count11
2D diagram of 917

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Chemical Component Summary

NameN-({(5S)-2-oxo-3-[4-(1,3-thiazol-5-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)acetamide
SynonymsLlinezolid-114
Systematic Name (OpenEye OEToolkits)~{N}-[[(5~{S})-2-oxidanylidene-3-[4-(1,3-thiazol-5-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]ethanamide
FormulaC15 H15 N3 O3 S
Molecular Weight317.363
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c2cc(c1cncs1)ccc2N3CC(CNC(C)=O)OC3=O
SMILESCACTVS3.385CC(=O)NC[CH]1CN(C(=O)O1)c2ccc(cc2)c3scnc3
SMILESOpenEye OEToolkits2.0.6CC(=O)NCC1CN(C(=O)O1)c2ccc(cc2)c3cncs3
Canonical SMILESCACTVS3.385 CC(=O)NC[C@H]1CN(C(=O)O1)c2ccc(cc2)c3scnc3
Canonical SMILESOpenEye OEToolkits2.0.6 CC(=O)NC[C@H]1CN(C(=O)O1)c2ccc(cc2)c3cncs3
InChIInChI1.03 InChI=1S/C15H15N3O3S/c1-10(19)17-6-13-8-18(15(20)21-13)12-4-2-11(3-5-12)14-7-16-9-22-14/h2-5,7,9,13H,6,8H2,1H3,(H,17,19)/t13-/m0/s1
InChIKeyInChI1.03 WTZZWIUUAPRUHM-ZDUSSCGKSA-N

Related Resource References

Resource NameReference
PubChem 129900336