METAMIZOLE QUININE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H24N2O2.C13H17N3O4S
Molecular Weight	635.774
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN(CS(O)(=O)=O)C1=C(C)N(C)N(C1=O)C2=CC=CC=C2.COC3=CC4=C(C=C3)N=CC=C4[C@@H](O)[C@@H]5C[C@@H]6CC[N@]5C[C@@H]6C=C

InChI

InChIKey=QAMWRMRIYODDLR-VCZKLPRJSA-N

InChI=1S/C20H24N2O2.C13H17N3O4S/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;4-8H,9H2,1-3H3,(H,18,19,20)/t13-,14+,19-,20+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C13H17N3O4S
Molecular Weight	311.357
Charge	0
Count

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

Molecular Formula	C20H24N2O2
Molecular Weight	324.4168
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 `Tue Apr 01 21:53:45 GMT 2025` Edited by `admin` on `Tue Apr 01 21:53:45 GMT 2025`
Record UNII	C6V3NP5052
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Metamizole quinine [WHO-DD]

Preferred Name

English

METAMIZOLE QUININE

Common Name

English

METHANESULFONIC ACID, ((2,3-DIHYDRO-1,5-DIMETHYL-3-OXO-2-PHENYL-1H-PYRAZOL-4-YL)METHYLAMINO)-, COMPD. WITH (8.ALPHA.,9R)-6'-METHOXYCINCHONAN-9-OL (1:1)

Systematic Name

English

(8ALPHA,9R)-6'-METHOXYCINCHONAN-9-OL, SALT WITH ((2,3-DIHYDRO-1,5-DIMETHYL-3-OXO-2-PHENYL-1H-PYRAZOL-4-YL)METHYLAMINO)METHANESULPHONIC ACID (1:1)

Systematic Name

English

CINCHONAN-9-OL, 6'-METHOXY-, (8.ALPHA.,9R)-, MONO(((2,3-DIHYDRO-1,5-DIMETHYL-3-OXO-2-PHENYL-1H-PYRAZOL-4-YL)METHYLAMINO)METHANESULFONATE) (SALT)

Systematic Name

English

Code System Code Type Description

CAS

97259-64-8

Created by admin on Tue Apr 01 21:53:45 GMT 2025 , Edited by admin on Tue Apr 01 21:53:45 GMT 2025

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FDA UNII

C6V3NP5052

Created by admin on Tue Apr 01 21:53:45 GMT 2025 , Edited by admin on Tue Apr 01 21:53:45 GMT 2025

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EPA CompTox

DTXSID40242826

Created by admin on Tue Apr 01 21:53:45 GMT 2025 , Edited by admin on Tue Apr 01 21:53:45 GMT 2025

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PUBCHEM

139593422

Created by admin on Tue Apr 01 21:53:45 GMT 2025 , Edited by admin on Tue Apr 01 21:53:45 GMT 2025

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