CP-506 mesylate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H29BrN4O8S2.CH4O3S
Molecular Weight	681.595
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=WJUPXQLICCCCRQ-UHFFFAOYSA-N

InChI=1S/C19H29BrN4O8S2.CH4O3S/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;1-5(2,3)4/h13-14H,4-12H2,1-3H3;1H3,(H,2,3,4)

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

Molecular Formula	CH4O3S
Molecular Weight	96.106
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 18:20:56 GMT 2023` Edited by `admin` on `Sat Dec 16 18:20:56 GMT 2023`
Record UNII	BE4AHC9Z26
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CP-506 mesylate

Code

English

(5-((2-BROMOETHYL)(2-((METHYLSULFONYL)OXY)ETHYL)AMINO)-4-(METHYLSULFONYL)-2-NITROPHENYL)(4-ETHYL-1-PIPERAZINYL)METHANONE METHANE SULFONIC ACID SALT

Systematic Name

English

METHANONE, (5-((2-BROMOETHYL)(2-((METHYLSULFONYL)OXY)ETHYL)AMINO)-4-(METHYLSULFONYL)-2-NITROPHENYL)(4-ETHYL-1-PIPERAZINYL)-, METHANE SULFONIC ACID SALT

Systematic Name

English

METHANONE, (5-((2-BROMOETHYL)(2-((METHYLSULFONYL)OXY)ETHYL)AMINO)-4-(METHYLSULFONYL)-2-NITROPHENYL)(4-ETHYL-1-PIPERAZINYL)-, COMPD. WITH METHANESULFONATE (1:1)

Systematic Name

English

(5-((2-BROMOETHYL)(2-((METHYLSULFONYL)OXY)ETHYL)AMINO)-4-(METHYLSULFONYL)-2-NITROPHENYL)(4-ETHYL-1-PIPERAZINYL)METHANONE MESYLATE

Common Name

English

Code System Code Type Description

FDA UNII

BE4AHC9Z26

Created by admin on Sat Dec 16 18:20:56 GMT 2023 , Edited by admin on Sat Dec 16 18:20:56 GMT 2023

PRIMARY

PUBCHEM

156239403

Created by admin on Sat Dec 16 18:20:56 GMT 2023 , Edited by admin on Sat Dec 16 18:20:56 GMT 2023

PRIMARY

CAS

2227304-19-8

Created by admin on Sat Dec 16 18:20:56 GMT 2023 , Edited by admin on Sat Dec 16 18:20:56 GMT 2023

PRIMARY

Related Record Type Details


					U884AYM4BN

CP-506

PARENT -> SALT/SOLVATE

Amount:

Related Record Type Details


					U884AYM4BN

CP-506

ACTIVE MOIETY

Amount: