HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

2-(4-Nitrophenoxy)-N-(4-oxo-2-(phenylimino)-3-thiazolidinyl)acetamide

HCID 60544
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
112122-50-6
Standard SMILES
O=C(COc1ccc([N+](=O)[O-])cc1)NN1C(=O)CSC1=Nc1ccccc1
InChIKey
SCWOJWZNFNUVGD-UHFFFAOYSA-N
Molecular formula
C17H14N4O5S
Average molar mass
386.4 g/mol
Monoisotopic mass
386.06849073

Names & identifiers

Preferred name
2-(4-Nitrophenoxy)-N-(4-oxo-2-(phenylimino)-3-thiazolidinyl)acetamide
IUPAC
2-(4-nitrophenoxy)-N-(4-oxo-2-phenylimino-1,3-thiazolidin-3-yl)acetamide

Names & synonyms

BRN 51637242-(4-Nitrophenoxy)-N-(4-oxo-2-(phenylimino)-3-thiazolidinyl)acetamide2-Phenylimino-3-(((4-nitrophenyl)oxy)acetamido)-4-thiazolidoneACETAMIDE, 2-(4-NITROPHENOXY)-N-(4-OXO-2-(PHENYLIMINO)-3-THIAZOLIDINYL)-112122-50-6

Database identifiers

CAS
112122-50-6
PubChem CID
60544

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
142 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
27
Formal charge
0
Complexity
595

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes