TOLVAPTAN PHOSPHATE SODIUM

Details

Stereochemistry	RACEMIC
Molecular Formula	C26H24ClN2O6P.2Na
Molecular Weight	572.885
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].CC1=CC=CC=C1C(=O)NC2=CC(C)=C(C=C2)C(=O)N3CCCC(OP([O-])([O-])=O)C4=C3C=CC(Cl)=C4

InChI

InChIKey=IHNKFKPPZJVMMZ-UHFFFAOYSA-L

InChI=1S/C26H26ClN2O6P.2Na/c1-16-6-3-4-7-20(16)25(30)28-19-10-11-21(17(2)14-19)26(31)29-13-5-8-24(35-36(32,33)34)22-15-18(27)9-12-23(22)29;;/h3-4,6-7,9-12,14-15,24H,5,8,13H2,1-2H3,(H,28,30)(H2,32,33,34);;/q;2*+1/p-2

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Molecular Formula	C26H24ClN2O6P
Molecular Weight	526.905
Charge	-2
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:08:03 GMT 2023` Edited by `admin` on `Sat Dec 16 18:08:03 GMT 2023`
Record UNII	Y4P6WS9QVF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TOLVAPTAN PHOSPHATE SODIUM

Common Name

English

DISODIUM (5RS)-7-CHLORO-1-(2-METHYL-4-(2-METHYLBENZAMIDO)BENZOYL)-2,3,4,5-TETRAHYDRO-1H-BENZAZEPIN-5-YL PHOSPHATE

Systematic Name

English

TOLVAPTAN SODIUM PHOSPHATE

Official Name

English

Tolvaptan disodium phosphate [WHO-DD]

Common Name

English

TOLVAPTAN SODIUM PHOSPHATE [JAN]

Common Name

English

BENZAMIDE, N-(4-((7-CHLORO-2,3,4,5-TETRAHYDRO-5-(PHOSPHONOOXY)-1H-1-BENZAZEPIN-1-YL)CARBONYL)-3-METHYLPHENYL)-2-METHYL-, SODIUM SALT (1:2)

Systematic Name

English

Code System Code Type Description

FDA UNII

Y4P6WS9QVF

Created by admin on Sat Dec 16 18:08:03 GMT 2023 , Edited by admin on Sat Dec 16 18:08:03 GMT 2023

PRIMARY

PUBCHEM

146035876

Created by admin on Sat Dec 16 18:08:03 GMT 2023 , Edited by admin on Sat Dec 16 18:08:03 GMT 2023

PRIMARY

SMS_ID

300000005800

Created by admin on Sat Dec 16 18:08:03 GMT 2023 , Edited by admin on Sat Dec 16 18:08:03 GMT 2023

PRIMARY

CAS

942619-79-6

Created by admin on Sat Dec 16 18:08:03 GMT 2023 , Edited by admin on Sat Dec 16 18:08:03 GMT 2023

PRIMARY

Related Record Type Details


					21G72T1950

TOLVAPTAN

PARENT -> SALT/SOLVATE

Amount: