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Details

Stereochemistry EPIMERIC
Molecular Formula C21H17ClF3NO2
Molecular Weight 407.813
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SG-275

SMILES

COC1=CC=C(C=C1)C2NC3=CC=C(Cl)C=C3[C@@](O2)(C#CC4CC4)C(F)(F)F

InChI

InChIKey=UTEUZELNJWOZOI-ANYOKISRSA-N
InChI=1S/C21H17ClF3NO2/c1-27-16-7-4-14(5-8-16)19-26-18-9-6-15(22)12-17(18)20(28-19,21(23,24)25)11-10-13-2-3-13/h4-9,12-13,19,26H,2-3H2,1H3/t19?,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H17ClF3NO2
Molecular Weight 407.813
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry
Defined Stereocenters 1 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Oct 22 13:19:08 UTC 2019
Edited
by admin
on Tue Oct 22 13:19:08 UTC 2019
Record UNII
S40TCL042S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SG-275
Common Name English
(2RS,4S)-6-CHLORO-4-(2-CYCLOPROPYLETH-1-YN-1-YL)-2-(4-METHOXYPHENYL)-4-(TRIFLUOROMETHYL)-1,4-DIHYDRO-2H-3,1-BENZOXAZINE
Systematic Name English
EFAVIRENZ IMPURITY I
Common Name English
Code System Code Type Description
EPA CompTox
209414-26-6
Created by admin on Tue Oct 22 13:19:08 UTC 2019 , Edited by admin on Tue Oct 22 13:19:08 UTC 2019
PRIMARY
CAS
209414-26-6
Created by admin on Tue Oct 22 13:19:08 UTC 2019 , Edited by admin on Tue Oct 22 13:19:08 UTC 2019
PRIMARY
PUBCHEM
11825698
Created by admin on Tue Oct 22 13:19:08 UTC 2019 , Edited by admin on Tue Oct 22 13:19:08 UTC 2019
PRIMARY
Related Record Type Details
PARENT -> IMPURITY