AROTINOLOL HYDROCHLORIDE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C15H21N3O2S3.ClH
Molecular Weight	408.002
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of AROTINOLOL HYDROCHLORIDE

Structure Search

SMILES

Cl.CC(C)(C)NCC(O)CSC1=NC(=CS1)C2=CC=C(S2)C(N)=O

InChI

InChIKey=XXDAXBZYUXLDRD-UHFFFAOYSA-N

InChI=1S/C15H21N3O2S3.ClH/c1-15(2,3)17-6-9(19)7-21-14-18-10(8-22-14)11-4-5-12(23-11)13(16)20;/h4-5,8-9,17,19H,6-7H2,1-3H3,(H2,16,20);1H

HIDE SMILES / InChI

Molecular Formula	C15H21N3O2S3
Molecular Weight	371.541
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Molecular Formula	ClH
Molecular Weight	36.461
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 `Fri Dec 15 17:02:56 UTC 2023` Edited by `admin` on `Fri Dec 15 17:02:56 UTC 2023`
Record UNII	9DOI1HT306
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AROTINOLOL HYDROCHLORIDE

Common Name

English

AROTINOLOL HYDROCHLORIDE [MART.]

Common Name

English

Arotinolol hydrochloride [WHO-DD]

Common Name

English

AROTINOLOL HCL

Common Name

English

AROTINOLOL HYDROCHLORIDE [JAN]

Common Name

English

2-THIOPHENECARBOXAMIDE, 5-(2-((3-((1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPYL)THIO)-4-THIAZOLYL)-, MONOHYDROCHLORIDE, (±)-

Common Name

English

(±)-2-(3'-TERT-BUTYLAMINO-2'-HYDROXYPROPYLTHIO)-4-(5'-CARBAMOYL-2'-THIENYL)THIAZOLE HCL

Common Name

English

AROTINOLOL HYDROCHLORIDE [MI]

Common Name

English

Code System Code Type Description

MERCK INDEX

m2052

Created by admin on Fri Dec 15 17:02:56 UTC 2023 , Edited by admin on Fri Dec 15 17:02:56 UTC 2023

PRIMARY

Merck Index

PUBCHEM

155032

Created by admin on Fri Dec 15 17:02:56 UTC 2023 , Edited by admin on Fri Dec 15 17:02:56 UTC 2023

PRIMARY

EPA CompTox

DTXSID1046849

Created by admin on Fri Dec 15 17:02:56 UTC 2023 , Edited by admin on Fri Dec 15 17:02:56 UTC 2023

PRIMARY

MESH

C024523

Created by admin on Fri Dec 15 17:02:56 UTC 2023 , Edited by admin on Fri Dec 15 17:02:56 UTC 2023

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SMS_ID

100000085340

Created by admin on Fri Dec 15 17:02:56 UTC 2023 , Edited by admin on Fri Dec 15 17:02:56 UTC 2023

PRIMARY

FDA UNII

9DOI1HT306

Created by admin on Fri Dec 15 17:02:56 UTC 2023 , Edited by admin on Fri Dec 15 17:02:56 UTC 2023

PRIMARY

EVMPD

SUB00590MIG

Created by admin on Fri Dec 15 17:02:56 UTC 2023 , Edited by admin on Fri Dec 15 17:02:56 UTC 2023

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ChEMBL

CHEMBL93298

Created by admin on Fri Dec 15 17:02:56 UTC 2023 , Edited by admin on Fri Dec 15 17:02:56 UTC 2023

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CAS

68377-91-3

Created by admin on Fri Dec 15 17:02:56 UTC 2023 , Edited by admin on Fri Dec 15 17:02:56 UTC 2023

PRIMARY

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ACTIVE MOIETY