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Details

Stereochemistry ACHIRAL
Molecular Formula C16H18N2O4S
Molecular Weight 334.39
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-(3-((HYDROXYIMINO)METHYL)-4-(2-METHYLPROPOXY)PHENYL)-4-METHYL-5-THIAZOLECARBOXYLIC ACID

SMILES

CC(C)COC1=C(\C=N\O)C=C(C=C1)C2=NC(C)=C(S2)C(O)=O

InChI

InChIKey=MDMGIABSBHFMNF-REZTVBANSA-N
InChI=1S/C16H18N2O4S/c1-9(2)8-22-13-5-4-11(6-12(13)7-17-21)15-18-10(3)14(23-15)16(19)20/h4-7,9,21H,8H2,1-3H3,(H,19,20)/b17-7+

HIDE SMILES / InChI

Molecular Formula C16H18N2O4S
Molecular Weight 334.39
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:13:24 GMT 2023
Edited
by admin
on Sat Dec 16 11:13:24 GMT 2023
Record UNII
5TD8E5Y9AJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3-((HYDROXYIMINO)METHYL)-4-(2-METHYLPROPOXY)PHENYL)-4-METHYL-5-THIAZOLECARBOXYLIC ACID
Systematic Name English
5-THIAZOLECARBOXYLIC ACID, 2-(3-((HYDROXYIMINO)METHYL)-4-(2-METHYLPROPOXY)PHENYL)-4-METHYL-
Systematic Name English
Code System Code Type Description
CAS
1350352-70-3
Created by admin on Sat Dec 16 11:13:24 GMT 2023 , Edited by admin on Sat Dec 16 11:13:24 GMT 2023
PRIMARY
FDA UNII
5TD8E5Y9AJ
Created by admin on Sat Dec 16 11:13:24 GMT 2023 , Edited by admin on Sat Dec 16 11:13:24 GMT 2023
PRIMARY
PUBCHEM
54588800
Created by admin on Sat Dec 16 11:13:24 GMT 2023 , Edited by admin on Sat Dec 16 11:13:24 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY