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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H17ClN3O4S2.Na
Molecular Weight 473.929
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 6-(5-PHENYL-4-THIAZOLECARBOXAMIDO)PENICILLANATE

SMILES

[Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C3=C(C)SN=C3C4=C(Cl)C=CC=C4)C([O-])=O

InChI

InChIKey=PSRMMAMLWHJOFC-SLINCCQESA-M
InChI=1S/C19H18ClN3O4S2.Na/c1-8-11(12(22-29-8)9-6-4-5-7-10(9)20)15(24)21-13-16(25)23-14(18(26)27)19(2,3)28-17(13)23;/h4-7,13-14,17H,1-3H3,(H,21,24)(H,26,27);/q;+1/p-1/t13-,14+,17-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C19H17ClN3O4S2
Molecular Weight 450.939
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

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 15:24:06 GMT 2023
Edited
by admin
on Fri Dec 15 15:24:06 GMT 2023
Record UNII
IE1BFP0ASE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 6-(5-PHENYL-4-THIAZOLECARBOXAMIDO)PENICILLANATE
Common Name English
6-(5-PHENYL-4-THIAZOLECARBOXAMIDO)PENICILLIN SODIUM
Common Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 3,3-DIMETHYL-7-OXO-6-(5-PHENYL-4-THIAZOLECARBOXAMIDO)-, MONOSODIUM SALT
Systematic Name English
6-(5-PHENYL-4-THIAZOLECARBOXAMIDO)PENICILLIN, SODIUM SALT
Common Name English
Code System Code Type Description
FDA UNII
IE1BFP0ASE
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
CAS
13949-64-9
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
PUBCHEM
133082337
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY