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Details

Stereochemistry RACEMIC
Molecular Formula C22H21N3O5S
Molecular Weight 439.484
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NIP-222

SMILES

CC1=C(N=C(O1)C2=CC=C(C)C=C2)C(O)COC3=CN=C(CC4SC(=O)NC4=O)C=C3

InChI

InChIKey=DIRLMEMGWIWYGP-UHFFFAOYSA-N
InChI=1S/C22H21N3O5S/c1-12-3-5-14(6-4-12)21-24-19(13(2)30-21)17(26)11-29-16-8-7-15(23-10-16)9-18-20(27)25-22(28)31-18/h3-8,10,17-18,26H,9,11H2,1-2H3,(H,25,27,28)

HIDE SMILES / InChI

Molecular Formula C22H21N3O5S
Molecular Weight 439.484
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:39:54 GMT 2023
Edited
by admin
on Sat Dec 16 09:39:54 GMT 2023
Record UNII
CLJ7R7F6W2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NIP-222
Code English
NIP222
Code English
5-((5-(2-HYDROXY-2-(5-METHYL-2-(4-METHYLPHENYL)-4-OXAZOLYL)ETHOXY)-2-PYRIDINYL)METHYL)-2,4-THIAZOLIDINEDIONE
Systematic Name English
2,4-THIAZOLIDINEDIONE, 5-((5-(2-HYDROXY-2-(5-METHYL-2-(4-METHYLPHENYL)-4-OXAZOLYL)ETHOXY)-2-PYRIDINYL)METHYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
10365915
Created by admin on Sat Dec 16 09:39:54 GMT 2023 , Edited by admin on Sat Dec 16 09:39:54 GMT 2023
PRIMARY
FDA UNII
CLJ7R7F6W2
Created by admin on Sat Dec 16 09:39:54 GMT 2023 , Edited by admin on Sat Dec 16 09:39:54 GMT 2023
PRIMARY
CAS
243147-25-3
Created by admin on Sat Dec 16 09:39:54 GMT 2023 , Edited by admin on Sat Dec 16 09:39:54 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY