SB-201993

Details

Stereochemistry	ACHIRAL
Molecular Formula	C32H37NO6S
Molecular Weight	563.704
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(CCCCCCCCOC2=C(\C=C\C(O)=O)N=C(CSCC3=CC(=CC=C3)C(O)=O)C=C2)C=C1

InChI

InChIKey=QQUXZUFSDIOIFJ-HTXNQAPBSA-N

InChI=1S/C32H37NO6S/c1-38-28-15-12-24(13-16-28)9-6-4-2-3-5-7-20-39-30-18-14-27(33-29(30)17-19-31(34)35)23-40-22-25-10-8-11-26(21-25)32(36)37/h8,10-19,21H,2-7,9,20,22-23H2,1H3,(H,34,35)(H,36,37)/b19-17+

HIDE SMILES / InChI

Molecular Formula	C32H37NO6S
Molecular Weight	563.704
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:14:34 GMT 2025` Edited by `admin` on `Mon Mar 31 18:14:34 GMT 2025`
Record UNII	4TWC061LPM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SB-201993

Code

English

BENZOIC ACID, 3-((((6-(2-CARBOXYETHENYL)-5-((8-(4-METHOXYPHENYL)OCTYL)OXY)-2-PYRIDINYL)METHYL)THIO)METHYL)-, (E)-

Preferred Name

English

3-((((6-(2-CARBOXYETHENYL)-5-((8-(4-METHOXYPHENYL)OCTYL)OXY)-2-PYRIDINYL)METHYL)THIO)METHYL)BENZOIC ACID (E)

Systematic Name

English

Code System Code Type Description

FDA UNII

4TWC061LPM

Created by admin on Mon Mar 31 18:14:34 GMT 2025 , Edited by admin on Mon Mar 31 18:14:34 GMT 2025

PRIMARY

PUBCHEM

6435820

Created by admin on Mon Mar 31 18:14:34 GMT 2025 , Edited by admin on Mon Mar 31 18:14:34 GMT 2025

PRIMARY

CAS

150399-22-7

Created by admin on Mon Mar 31 18:14:34 GMT 2025 , Edited by admin on Mon Mar 31 18:14:34 GMT 2025

PRIMARY