CLOFAZIMINE HYDROGEN-SULFATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H23ClN4O4S
Molecular Weight	535.014
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of CLOFAZIMINE HYDROGEN-SULFATE

Structure Search

SMILES

CC(C)\N=C1/C=C2N(C3=CC=C(Cl)C=C3)C4=CC=CC=C4N=C2C=C1NC5=CC=C(OS(O)(=O)=O)C=C5

InChI

InChIKey=YRJSPGQHSGHYAX-RMLRFSFXSA-N

InChI=1S/C27H23ClN4O4S/c1-17(2)29-24-16-27-25(15-23(24)30-19-9-13-21(14-10-19)36-37(33,34)35)31-22-5-3-4-6-26(22)32(27)20-11-7-18(28)8-12-20/h3-17,30H,1-2H3,(H,33,34,35)/b29-24+

HIDE SMILES / InChI

Molecular Formula	C27H23ClN4O4S
Molecular Weight	535.014
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 13:56:29 GMT 2023` Edited by `admin` on `Sat Dec 16 13:56:29 GMT 2023`
Record UNII	G9ZDT91MJ9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CLOFAZIMINE HYDROGEN-SULFATE

Common Name

English

PHENOL, 4-((5-(4-CHLOROPHENYL)-3,5-DIHYDRO-3-((1-METHYLETHYL)IMINO)-2-PHENAZINYL)AMINO)-, 1-(HYDROGEN SULFATE)

Systematic Name

English

Code System Code Type Description

CAS

190319-58-5

Created by admin on Sat Dec 16 13:56:29 GMT 2023 , Edited by admin on Sat Dec 16 13:56:29 GMT 2023

PRIMARY

FDA UNII

G9ZDT91MJ9

Created by admin on Sat Dec 16 13:56:29 GMT 2023 , Edited by admin on Sat Dec 16 13:56:29 GMT 2023

PRIMARY

Related Record Type Details


					D959AE5USF

CLOFAZIMINE

PARENT -> METABOLITE

Comments:

Human Clofazimine metabolite thru Sulfate conjugation