NEBENTAN POTASSIUM

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H20N5O5S.K
Molecular Weight	529.609
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[K+].COC1=CC=CC=C1OC2=C([N-]S(=O)(=O)\C=C\C3=CC=CC=C3)N=C(N=C2OC)C4=NC=CC=N4

InChI

InChIKey=WOPWEXSDEXIRNG-ZUQRMPMESA-N

InChI=1S/C24H20N5O5S.K/c1-32-18-11-6-7-12-19(18)34-20-21(29-35(30,31)16-13-17-9-4-3-5-10-17)27-23(28-24(20)33-2)22-25-14-8-15-26-22;/h3-16H,1-2H3;/q-1;+1/b16-13+;

HIDE SMILES / InChI

Molecular Formula	C24H21N5O5S
Molecular Weight	491.519
Charge	0
Count

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

Molecular Formula	K
Molecular Weight	39.0983
Charge	1
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 `Fri Dec 15 15:46:44 GMT 2023` Edited by `admin` on `Fri Dec 15 15:46:44 GMT 2023`
Record UNII	OK6K3MDZ98
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NEBENTAN POTASSIUM

Common Name

English

ETHENESULFONAMIDE, N-(6-METHOXY-5-(2-METHOXYPHENOXY)(2,2'-BIPYRIMIDIN)-4-YL)-2-PHENYL-, POTASSIUM SALT (1:1), (1E)-

Systematic Name

English

YM-598

Code

English

YM598

Code

English

Code System Code Type Description

NCI_THESAURUS

C26678