264W94

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H31NO4S
Molecular Weight	417.562
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCC[C@]1(CC)CS(=O)(=O)C2=CC(OC)=C(OC)C=C2[C@H](N1)C3=CC=CC=C3

InChI

InChIKey=CKFWDLFFXXVSBJ-DHIUTWEWSA-N

InChI=1S/C23H31NO4S/c1-5-7-13-23(6-2)16-29(25,26)21-15-20(28-4)19(27-3)14-18(21)22(24-23)17-11-9-8-10-12-17/h8-12,14-15,22,24H,5-7,13,16H2,1-4H3/t22-,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H31NO4S
Molecular Weight	417.562
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
A novel class of apical sodium co-dependent bile acid transporter inhibitors: the 1,2-benzothiazepines.	2003 Nov 3	14552767
Discovery of a highly potent, nonabsorbable apical sodium-dependent bile acid transporter inhibitor (GSK2330672) for treatment of type 2 diabetes.	2013 Jun 27	23678871

Patents

Substance Class	Chemical Created by `admin` on `Tue Apr 01 23:32:37 GMT 2025` Edited by `admin` on `Tue Apr 01 23:32:37 GMT 2025`
Record UNII	8GYW8T88JI
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

264W94

Code

English

(-)-(3R,5R)-TRANS-3-BUTYL-3-ETHYL-2,3,4,5-TETRAHYDRO-7,8-DIMETHOXY-5-PHENYL-1,4-BENZOTHIAZEPINE, 1,1-DIOXIDE

Preferred Name

English

1,4-BENZOTHIAZEPINE, 3-BUTYL-3-ETHYL-2,3,4,5-TETRAHYDRO-7,8-DIMETHOXY-5-PHENYL-, 1,1-DIOXIDE, (3R-TRANS)-

Systematic Name

English

1,4-BENZOTHIAZEPINE, 3-BUTYL-3-ETHYL-2,3,4,5-TETRAHYDRO-7,8-DIMETHOXY-5-PHENYL-, 1,1-DIOXIDE, (3R,5R)-

Systematic Name

English

Code System Code Type Description

CAS

178961-24-5

Created by admin on Tue Apr 01 23:32:37 GMT 2025 , Edited by admin on Tue Apr 01 23:32:37 GMT 2025

NON-SPECIFIC STEREOCHEMISTRY

FDA UNII

8GYW8T88JI

Created by admin on Tue Apr 01 23:32:37 GMT 2025 , Edited by admin on Tue Apr 01 23:32:37 GMT 2025

PRIMARY

CAS

178259-25-1

Created by admin on Tue Apr 01 23:32:37 GMT 2025 , Edited by admin on Tue Apr 01 23:32:37 GMT 2025

PRIMARY

PUBCHEM

9823277

Created by admin on Tue Apr 01 23:32:37 GMT 2025 , Edited by admin on Tue Apr 01 23:32:37 GMT 2025

PRIMARY

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