5-Bromo-N-[2-[4-[[[(cyclohexylamino)carbonyl]amino]sulfonyl]phenyl]ethyl]-2-methoxy-3-pyridinecarboxamide sodium salt

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H27BrN4O5S.Na
Molecular Weight	563.44
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-Bromo-N-[2-[4-[[[(cyclohexylamino)carbonyl]amino]sulfonyl]phenyl]ethyl]-2-methoxy-3-pyridinecarboxamide sodium salt

Structure Search

SMILES

[NaH].COC1=NC=C(Br)C=C1C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3

InChI

InChIKey=ZVBUCWPQMOKDDV-UHFFFAOYSA-N

InChI=1S/C22H27BrN4O5S.Na.H/c1-32-21-19(13-16(23)14-25-21)20(28)24-12-11-15-7-9-18(10-8-15)33(30,31)27-22(29)26-17-5-3-2-4-6-17;;/h7-10,13-14,17H,2-6,11-12H2,1H3,(H,24,28)(H2,26,27,29);;

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	23.99771
Charge	0
Count

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

Molecular Formula	C22H27BrN4O5S
Molecular Weight	539.443
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 `Mon Mar 31 22:36:38 GMT 2025` Edited by `admin` on `Mon Mar 31 22:36:38 GMT 2025`
Record UNII	57839YY8KK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Pyridinecarboxamide, 5-bromo-N-[2-[4-[[[(cyclohexylamino)carbonyl]amino]sulfonyl]phenyl]ethyl]-2-methoxy-, monosodium salt

Preferred Name

English

5-Bromo-N-[2-[4-[[[(cyclohexylamino)carbonyl]amino]sulfonyl]phenyl]ethyl]-2-methoxy-3-pyridinecarboxamide sodium salt

Systematic Name

English

NSC-301161

Code

English

3-Pyridinecarboxamide, 5-bromo-N-[2-[4-[[[(cyclohexylamino)carbonyl]amino]sulfonyl]phenyl]ethyl]-2-methoxy-, sodium salt (1:1)

Systematic Name

English

Sodium 5-bromo-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxypyridine-3-carboxamide

Systematic Name

English

Code System Code Type Description

PUBCHEM

54607417