TBC-3711 SODIUM

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H20N3O5S2.Na
Molecular Weight	469.51
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].CC(=O)C1=C(NC(=O)C2=C(C=CS2)S(=O)(=O)[N-]C3=C(C)C(C)=NO3)C(C)=CC(C)=C1

InChI

InChIKey=XQTFFNMDNQTAJC-UHFFFAOYSA-M

InChI=1S/C20H21N3O5S2.Na/c1-10-8-11(2)17(15(9-10)14(5)24)21-19(25)18-16(6-7-29-18)30(26,27)23-20-12(3)13(4)22-28-20;/h6-9H,1-5H3,(H2,21,22,23,24,25);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	0
Count

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

Molecular Formula	C20H21N3O5S2
Molecular Weight	447.528
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 11:29:50 GMT 2023` Edited by `admin` on `Sat Dec 16 11:29:50 GMT 2023`
Record UNII	I7X0X51T8Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TBC-3711 SODIUM

Common Name

English

2-THIOPHENECARBOXAMIDE, N-(2-ACETYL-4,6-DIMETHYLPHENYL)-3-(((3,4-DIMETHYL-5-ISOXAZOLYL)AMINO)SULFONYL)-, SODIUM SALT (1:1)

Systematic Name

English

N-(2-ACETYL-4,6-DIMETHYL-PHENYL)-3-((3,4-DIMETHYLISOXAZOL-5-YL)SULFAMOYL)THIOPHENE-2-CARBOXAMIDE SODIUM

Systematic Name

English

Code System Code Type Description

PUBCHEM

20616918

Created by admin on Sat Dec 16 11:29:50 GMT 2023 , Edited by admin on Sat Dec 16 11:29:50 GMT 2023

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FDA UNII

I7X0X51T8Q

Created by admin on Sat Dec 16 11:29:50 GMT 2023 , Edited by admin on Sat Dec 16 11:29:50 GMT 2023

PRIMARY

CAS

349453-84-5

Created by admin on Sat Dec 16 11:29:50 GMT 2023 , Edited by admin on Sat Dec 16 11:29:50 GMT 2023

PRIMARY

Related Record Type Details


					BDP0YZR82B

TBC-3711

PARENT -> SALT/SOLVATE