Chemical Compound

SCHEMBL3308852

Back to search Request a Quote
SCHEMBL3308852 chemical structure
Primary Record

SCHEMBL3308852

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
86609029
SMILES
CN1CCC2=C(C1)SC(=N2)C(=O)N[C@@H]3C[C@H](CC[C@@H]3NC(=S)C(=O)NC4=NC=C(C=C4)F)C(=O)N(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.O
Canonical SMILES
CN1CCc2nc(C(=O)N[C@@H]3C[C@@H](C(=O)N(C)C)CC[C@@H]3NC(=S)C(=O)Nc3ccc(F)cn3)sc2C1.O.O=C(O)CC(O)(CC(=O)O)C(=O)O

Names & Synonyms

  • SCHEMBL3308852
  • WABXTWPWPAZCQH-SJILXJHISA-N
  • N-[(1R,2S,5S)-5-[(dimethylamino)carbonyl]-2-({2-[(5-fluoropyridin-2-yl)amino]-2-oxoethanethioyl}amino)cyclohexyl]-5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxamide citric acid monohydrate