Chemical Compound

CHEMBL47318

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CHEMBL47318 chemical structure
Primary Record

CHEMBL47318

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
44293428
SMILES
CN(C(CN1CCCC1)C2=CC=C(C=C2)NC(=O)CNC(=O)CNC(=S)NC3=CC(=C(C=C3)C4=C5C=CC(=O)C=C5OC6=C4C=CC(=C6)O)C(=O)O)C(=O)CC7=CC(=C(C=C7)Cl)Cl
Canonical SMILES
CN(C(=O)Cc1ccc(Cl)c(Cl)c1)C(CN1CCCC1)c1ccc(NC(=O)CNC(=O)CNC(=S)Nc2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)cc1

Names & Synonyms

  • CHEMBL47318
  • CHEMBL1178866
  • BDBM50050752
  • 5-{3-[({[4-(1-{[2-(3,4-Dichloro-phenyl)-acetyl]-methyl-amino}-2-pyrrolidin-1-yl-ethyl)-phenylcarbamoyl]-methyl}-carbamoyl)-methyl]-thioureido}-2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)-benzoic acid; compound with triethyl-amine