DASOLAMPANEL ETIBUTIL TOSYLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H32ClN5O3.C7H8O3S
Molecular Weight	634.187
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DASOLAMPANEL ETIBUTIL TOSYLATE

Structure Search

SMILES

CC1=CC=C(C=C1)S(O)(=O)=O.[H][C@@]23CC[C@@H](C[C@]2([H])C[C@H](NC3)C(=O)OCC(CC)CC)OC4=C(C5=NN=NN5)C(Cl)=CC=C4

InChI

InChIKey=WLTMCPAAIJIZKG-BVNPURGCSA-N

InChI=1S/C23H32ClN5O3.C7H8O3S/c1-3-14(4-2)13-31-23(30)19-11-16-10-17(9-8-15(16)12-25-19)32-20-7-5-6-18(24)21(20)22-26-28-29-27-22;1-6-2-4-7(5-3-6)11(8,9)10/h5-7,14-17,19,25H,3-4,8-13H2,1-2H3,(H,26,27,28,29);2-5H,1H3,(H,8,9,10)/t15-,16+,17-,19-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C7H8O3S
Molecular Weight	172.202
Charge	0
Count

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

Molecular Formula	C23H32ClN5O3
Molecular Weight	461.985
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:30:43 UTC 2023` Edited by `admin` on `Sat Dec 16 01:30:43 UTC 2023`
Record UNII	9QY59JQF76
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DASOLAMPANEL ETIBUTIL TOSYLATE

Official Name

English

DASOLAMPANEL ETIBUTIL TOSYLATE [USAN]

Common Name

English

3-ISOQUINOLINECARBOXYLIC ACID, 6-(3-CHLORO-2-(1H-TETRAZOL-5-YL)PHENOXY)DECAHYDRO-, 2-ETHYLBUTYL ESTER, (3S,4AS,6S,8AR)-, MONO(4-METHYLBENZENESULFONATE)

Common Name

English

Code System Code Type Description

FDA UNII

9QY59JQF76