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Details

Stereochemistry ACHIRAL
Molecular Formula C19H29BrN4O8S2
Molecular Weight 585.49
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CP-506

SMILES

CCN1CCN(CC1)C(=O)C2=CC(N(CCBr)CCOS(C)(=O)=O)=C(C=C2[N+]([O-])=O)S(C)(=O)=O

InChI

InChIKey=SKBYSCFKFJRHSZ-UHFFFAOYSA-N
InChI=1S/C19H29BrN4O8S2/c1-4-21-7-9-23(10-8-21)19(25)15-13-17(18(33(2,28)29)14-16(15)24(26)27)22(6-5-20)11-12-32-34(3,30)31/h13-14H,4-12H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C19H29BrN4O8S2
Molecular Weight 585.49
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:26:37 GMT 2023
Edited
by admin
on Sat Dec 16 18:26:37 GMT 2023
Record UNII
U884AYM4BN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CP-506
Code English
METHANONE, (5-((2-BROMOETHYL)(2-((METHYLSULFONYL)OXY)ETHYL)AMINO)-4-(METHYLSULFONYL)-2-NITROPHENYL)(4-ETHYL-1-PIPERAZINYL)-
Common Name English
(5-((2-BROMOETHYL)(2-((METHYLSULFONYL)OXY)ETHYL)AMINO)-4-(METHYLSULFONYL)-2-NITROPHENYL)(4-ETHYL-1-PIPERAZINYL)METHANONE
Common Name English
Code System Code Type Description
FDA UNII
U884AYM4BN
Created by admin on Sat Dec 16 18:26:37 GMT 2023 , Edited by admin on Sat Dec 16 18:26:37 GMT 2023
PRIMARY
CAS
2227303-52-6
Created by admin on Sat Dec 16 18:26:37 GMT 2023 , Edited by admin on Sat Dec 16 18:26:37 GMT 2023
PRIMARY
PUBCHEM
90043890
Created by admin on Sat Dec 16 18:26:37 GMT 2023 , Edited by admin on Sat Dec 16 18:26:37 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
METABOLITE ACTIVE -> PARENT