CETIEDIL CITRATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C20H31NO2S.C6H8O7
Molecular Weight	541.654
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.O=C(OCCN1CCCCCC1)C(C2CCCCC2)C3=CSC=C3

InChI

InChIKey=XMGJGSKRRWXOIF-UHFFFAOYSA-N

InChI=1S/C20H31NO2S.C6H8O7/c22-20(23-14-13-21-11-6-1-2-7-12-21)19(18-10-15-24-16-18)17-8-4-3-5-9-17;7-3(8)1-6(13,5(11)12)2-4(9)10/h10,15-17,19H,1-9,11-14H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C6H8O7
Molecular Weight	192.1235
Charge	0
Count

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

Molecular Formula	C20H31NO2S
Molecular Weight	349.531
Charge	0
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 `Fri Dec 15 17:40:24 UTC 2023` Edited by `admin` on `Fri Dec 15 17:40:24 UTC 2023`
Record UNII	IE65P4OE02
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CETIEDIL CITRATE

Official Name

English

STRATENE

Brand Name

English

3-THIOPHENEACETIC ACID, .ALPHA.-CYCLOHEXYL-, 2-(HEXAHYDRO-1H-AZEPIN-1-YL)ETHYL ESTER, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1)

Common Name

English

VASOCET

Brand Name

English

CETIEDIL CITRATE [USAN]

Common Name

English

CELSIS

Brand Name

English

CETIEDIL CITRATE [MI]

Common Name

English

CETIEDIL CITRATE [MART.]

Common Name

English

2-(Hexahydro-1H-azepin-1-yl)ethyl α-cyclohexyl-3-thiopheneacetate citrate (1:1)

Systematic Name

English

Cetiedil citrate [WHO-DD]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29707