7U85 MESILATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H24N2O2.CH4O3S
Molecular Weight	444.544
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CS(O)(=O)=O.CN1C2=C(C=C(CNC(C)(CO)CO)C=C2)C3=C1C=CC4=C3C=CC=C4

InChI

InChIKey=UZABHARTWHOGJW-UHFFFAOYSA-N

InChI=1S/C22H24N2O2.CH4O3S/c1-22(13-25,14-26)23-12-15-7-9-19-18(11-15)21-17-6-4-3-5-16(17)8-10-20(21)24(19)2;1-5(2,3)4/h3-11,23,25-26H,12-14H2,1-2H3;1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula	CH4O3S
Molecular Weight	96.106
Charge	0
Count

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

Molecular Formula	C22H24N2O2
Molecular Weight	348.4382
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 01:40:12 GMT 2025` Edited by `admin` on `Wed Apr 02 01:40:12 GMT 2025`
Record UNII	9DT8JS5U63
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

7U85 MESILATE

Common Name

English

1,3-PROPANEDIOL, 2-METHYL-2-(((7-METHYL-7H-BENZO(C)CARBAZOL-10-YL)METHYL)AMINO)-, METHANESULFONATE (1:1)

Preferred Name

English

Code System Code Type Description

PUBCHEM

137552092

Created by admin on Wed Apr 02 01:40:12 GMT 2025 , Edited by admin on Wed Apr 02 01:40:12 GMT 2025

PRIMARY

FDA UNII

9DT8JS5U63

Created by admin on Wed Apr 02 01:40:12 GMT 2025 , Edited by admin on Wed Apr 02 01:40:12 GMT 2025

PRIMARY

CAS

158918-19-5

Created by admin on Wed Apr 02 01:40:12 GMT 2025 , Edited by admin on Wed Apr 02 01:40:12 GMT 2025

PRIMARY

Related Record Type Details


					5O3I3XEBNQ

7U85

PARENT -> SALT/SOLVATE

Related Record Type Details


					5O3I3XEBNQ

7U85

ACTIVE MOIETY