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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H33Cl2F2N5O2
Molecular Weight 604.518
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DRAFLAZINE, (S)-

SMILES

NC(=O)[C@@H]1CN(CCCCC(C2=CC=C(F)C=C2)C3=CC=C(F)C=C3)CCN1CC(=O)NC4=C(Cl)C=C(N)C=C4Cl

InChI

InChIKey=IWMYIWLIESDFRZ-MHZLTWQESA-N
InChI=1S/C30H33Cl2F2N5O2/c31-25-15-23(35)16-26(32)29(25)37-28(40)18-39-14-13-38(17-27(39)30(36)41)12-2-1-3-24(19-4-8-21(33)9-5-19)20-6-10-22(34)11-7-20/h4-11,15-16,24,27H,1-3,12-14,17-18,35H2,(H2,36,41)(H,37,40)/t27-/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H33Cl2F2N5O2
Molecular Weight 604.518
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:37:25 GMT 2023
Edited
by admin
on Fri Dec 15 15:37:25 GMT 2023
Record UNII
0EUB44LCL9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DRAFLAZINE, (S)-
Common Name English
R88021
Code English
R-88021
Code English
(-)-R-75231
Code English
(S)-(-)-DRAFLAZINE
Common Name English
1-PIPERAZINEACETAMIDE, 2-(AMINOCARBONYL)-N-(4-AMINO-2,6-DICHLOROPHENYL)-4-(5,5-BIS(4-FLUOROPHENYL)PENTYL)-, (S)-
Common Name English
1-PIPERAZINEACETAMIDE, 2-(AMINOCARBONYL)-N-(4-AMINO-2,6-DICHLOROPHENYL)-4-(5,5-BIS(4-FLUOROPHENYL)PENTYL)-, (2S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
9873580
Created by admin on Fri Dec 15 15:37:25 GMT 2023 , Edited by admin on Fri Dec 15 15:37:25 GMT 2023
PRIMARY
FDA UNII
0EUB44LCL9
Created by admin on Fri Dec 15 15:37:25 GMT 2023 , Edited by admin on Fri Dec 15 15:37:25 GMT 2023
PRIMARY
CAS
138681-29-5
Created by admin on Fri Dec 15 15:37:25 GMT 2023 , Edited by admin on Fri Dec 15 15:37:25 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER
ENANTIOMER -> ENANTIOMER