Chemical Compound

CHEMBL3903850

CHEMBL3903850 chemical structure
Primary Record

CHEMBL3903850

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
70982977
SMILES
CC1=NC(=NC=C1)NC2=CC(=CC(=C2)C3=CN=C(S3)CC4(CCC(CC4)C(=O)O)O)C
Canonical SMILES
Cc1cc(Nc2nccc(C)n2)cc(-c2cnc(CC3(O)CCC(C(=O)O)CC3)s2)c1

Names & Synonyms

  • CHEMBL3903850
  • SCHEMBL13737433
  • SCHEMBL13737439
  • SCHEMBL13737442
  • BDBM212247
  • US9290490, Example 5, Step 3 (trans isomer)