Chemical Compound

Nicotinamide Impurity 1

CAS Registry Number 4090-29-3
Nicotinamide Impurity 1 chemical structure
Primary Record

Nicotinamide Impurity 1

In stock
3,940 g
Purity
98.7 %
CAS
4090-29-3

Compound Identifiers & Properties

CAS
4090-29-3
PubChem CID
176483718
SMILES
C1=CC=[N+](C(=C1)C(=S)N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)OP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O
Canonical SMILES
NC(=S)c1cccc[n+]1[C@@H]1O[C@H](CO)[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@H]1O

Names & Synonyms

  • Nicotinamide Impurity 1
  • 4090-29-3