SB-773812 MALEATE

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H26ClNO4S.C4H4O4
Molecular Weight	588.068
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.COC1=C(C=C2CCN(C)CCC2=C1)S(=O)(=O)C3=CC=C(OCC4=CC=C(Cl)C=C4)C=C3

InChI

InChIKey=FJROTJLEHTXBIN-BTJKTKAUSA-N

InChI=1S/C25H26ClNO4S.C4H4O4/c1-27-13-11-19-15-24(30-2)25(16-20(19)12-14-27)32(28,29)23-9-7-22(8-10-23)31-17-18-3-5-21(26)6-4-18;5-3(6)1-2-4(7)8/h3-10,15-16H,11-14,17H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

HIDE SMILES / InChI

Molecular Formula	C25H26ClNO4S
Molecular Weight	471.996
Charge	0
Count

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

Molecular Formula	C4H4O4
Molecular Weight	116.0722
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 `Fri Dec 15 15:48:27 UTC 2023` Edited by `admin` on `Fri Dec 15 15:48:27 UTC 2023`
Record UNII	MJB5AWG007
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SB-773812 MALEATE

Code

English

SB773812 MALEATE

Code

English

1H-3-BENZAZEPINE, 7-((4-((4-CHLOROPHENYL)METHOXY)PHENYL)SULFONYL)-2,3,4,5-TETRAHYDRO-8-METHOXY-3-METHYL-, MALEATE

Systematic Name

English

Code System Code Type Description

FDA UNII

MJB5AWG007

Created by admin on Fri Dec 15 15:48:27 UTC 2023 , Edited by admin on Fri Dec 15 15:48:27 UTC 2023

PRIMARY

PUBCHEM

11467402

Created by admin on Fri Dec 15 15:48:27 UTC 2023 , Edited by admin on Fri Dec 15 15:48:27 UTC 2023

PRIMARY

CAS

853402-95-6

Created by admin on Fri Dec 15 15:48:27 UTC 2023 , Edited by admin on Fri Dec 15 15:48:27 UTC 2023

PRIMARY

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