THIOTHIXENE DIOXALATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H29N3O2S2.2C2H2O4
Molecular Weight	623.695
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)C(O)=O.OC(=O)C(O)=O.CN(C)S(=O)(=O)C1=CC2=C(SC3=CC=CC=C3\C2=C\CCN4CCN(C)CC4)C=C1

InChI

InChIKey=YQOSZOPIQWHNDH-INHJUQNSSA-N

InChI=1S/C23H29N3O2S2.2C2H2O4/c1-24(2)30(27,28)18-10-11-23-21(17-18)19(20-7-4-5-9-22(20)29-23)8-6-12-26-15-13-25(3)14-16-26;2*3-1(4)2(5)6/h4-5,7-11,17H,6,12-16H2,1-3H3;2*(H,3,4)(H,5,6)/b19-8-;;

HIDE SMILES / InChI

Molecular Formula	C23H29N3O2S2
Molecular Weight	443.625
Charge	0
Count

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

Molecular Formula	C2H2O4
Molecular Weight	90.0349
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 `Sat Dec 16 08:59:20 GMT 2023` Edited by `admin` on `Sat Dec 16 08:59:20 GMT 2023`
Record UNII	1J9VRR14LW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

THIOTHIXENE DIOXALATE

Common Name

English

THIOTHIXENE DIOXALATE [MI]

Common Name

English

N,N-DIMETHYL-9-(3-(4-METHYL-1-PIPERAZINYL)PROPYLIDENE)-9H-THIOXANTHENE-2-SULFONAMIDE, DIOXALATE

Systematic Name

English

9H-THIOXANTHENE-2-SULFONAMIDE, N,N-DIMETHYL-9-(3-(4-METHYL-1-PIPERAZINYL)PROPYLIDENE)-, ETHANEDIOATE (1:2)

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m10789

Created by admin on Sat Dec 16 08:59:20 GMT 2023 , Edited by admin on Sat Dec 16 08:59:20 GMT 2023

PRIMARY

Merck Index

PUBCHEM

90479405

Created by admin on Sat Dec 16 08:59:20 GMT 2023 , Edited by admin on Sat Dec 16 08:59:20 GMT 2023

PRIMARY

FDA UNII

1J9VRR14LW

Created by admin on Sat Dec 16 08:59:20 GMT 2023 , Edited by admin on Sat Dec 16 08:59:20 GMT 2023

PRIMARY

CAS

3285-54-9

Created by admin on Sat Dec 16 08:59:20 GMT 2023 , Edited by admin on Sat Dec 16 08:59:20 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY