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Details

Stereochemistry RACEMIC
Molecular Formula C16H15ClN3O3S.Na
Molecular Weight 387.816
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METOLAZONE SODIUM

SMILES

[Na+].CC1NC2=CC(Cl)=C(C=C2C(=O)N1C3=C(C)C=CC=C3)S([NH-])(=O)=O

InChI

InChIKey=IWCGZZSHDMZBQR-UHFFFAOYSA-M
InChI=1S/C16H16ClN3O3S.Na/c1-9-5-3-4-6-14(9)20-10(2)19-13-8-12(17)15(24(18,22)23)7-11(13)16(20)21;/h3-8,10H,1-2H3,(H3,18,19,21,22,23);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C16H16ClN3O3S
Molecular Weight 365.835
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
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 15:16:10 UTC 2023
Edited
by admin
on Fri Dec 15 15:16:10 UTC 2023
Record UNII
Q3AVC19UXB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METOLAZONE SODIUM
Common Name English
6-QUINAZOLINESULFONAMIDE, 7-CHLORO-1,2,3,4-TETRAHYDRO-2-METHYL-3-(2-METHYLPHENYL)-4-OXO-, SODIUM SALT (1:1)
Systematic Name English
6-QUINAZOLINESULFONAMIDE, 7-CHLORO-1,2,3,4-TETRAHYDRO-2-METHYL-3-(2-METHYLPHENYL)-4-OXO-, MONOSODIUM SALT
Systematic Name English
Code System Code Type Description
CAS
50869-23-3
Created by admin on Fri Dec 15 15:16:10 UTC 2023 , Edited by admin on Fri Dec 15 15:16:10 UTC 2023
PRIMARY
PUBCHEM
91667967
Created by admin on Fri Dec 15 15:16:10 UTC 2023 , Edited by admin on Fri Dec 15 15:16:10 UTC 2023
PRIMARY
FDA UNII
Q3AVC19UXB
Created by admin on Fri Dec 15 15:16:10 UTC 2023 , Edited by admin on Fri Dec 15 15:16:10 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY