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ZC0

Summary
Name:Contezolid
Synonyms:MRX-I
Formula:C18 H15 F3 N4 O4
Formal charge:0
Formula weight:408.331 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.011-{2,3,6-trifluoro-4-[(5S)-5-{[(1,2-oxazol-3-yl)amino]methyl}-2-oxo-1,3-oxazolidin-3-yl]phenyl}-2,3-dihydropyridin-4(1H)-one
OpenEye OEToolkits2.0.7(5~{S})-5-[(1,2-oxazol-3-ylamino)methyl]-3-[2,3,5-tris(fluoranyl)-4-(4-oxidanylidene-2,3-dihydropyridin-1-yl)phenyl]-1,3-oxazolidin-2-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C1C(C=CN(C1)c2c(F)cc(c(c2F)F)N3CC(OC3=O)CNc4ccon4)=O
InChIInChI1.03InChI=1S/C18H15F3N4O4/c19-12-7-13(15(20)16(21)17(12)24-4-1-10(26)2-5-24)25-9-11(29-18(25)27)8-22-14-3-6-28-23-14/h1,3-4,6-7,11H,2,5,8-9H2,(H,22,23)/t11-/m0/s1
InChIKeyInChI1.03SULYVXZZUMRQAX-NSHDSACASA-N
SMILES_CANONICALCACTVS3.385Fc1cc(N2C[C@H](CNc3ccon3)OC2=O)c(F)c(F)c1N4CCC(=O)C=C4
SMILESCACTVS3.385Fc1cc(N2C[CH](CNc3ccon3)OC2=O)c(F)c(F)c1N4CCC(=O)C=C4
SMILES_CANONICALOpenEye OEToolkits2.0.7c1conc1NC[C@H]2CN(C(=O)O2)c3cc(c(c(c3F)F)N4CCC(=O)C=C4)F
SMILESOpenEye OEToolkits2.0.7c1conc1NCC2CN(C(=O)O2)c3cc(c(c(c3F)F)N4CCC(=O)C=C4)F

236963

PDB entries from 2025-06-04

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