Chemical Compound

SCHEMBL21039260

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SCHEMBL21039260 chemical structure
Primary Record

SCHEMBL21039260

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
140924618
SMILES
C[C@H]1C/C=C/[C@@]([C@@H]2CC[C@H]2CN3C[C@@]4(CCCC5=C4C=CC(=C5)Cl)COC6=C3C=C(C=C6)C(=O)NS(=O)(=O)[C@@H]1C)(CN7CCN8CCN(C[C@@H]8C7)C(=O)C)OC
Canonical SMILES
CO[C@]1(CN2CCN3CCN(C(C)=O)C[C@@H]3C2)/C=C/C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3c(c2)N(C[C@@H]2CC[C@H]21)C[C@@]1(CCCc2cc(Cl)ccc21)CO3

Names & Synonyms

  • SCHEMBL21039260
  • BDBM470833
  • US10821115, Example 218
  • US10821115, Example 229
  • US10821115, Example 230
  • (1S,3''''R,6''''R,7''''R,8''''E,11''''S,12''''R)- 7''''-(((9aR)-8-acetyloctahydro- 2H-pyrazino[1,2-a]pyrazin-2- yl)methyl)-6-chloro-7''''- methoxy-11'''',12''''-dimethyl-3,4- dihydro-2H,15''''H- spiro[naphthalene-1,22''''- [20]oxa[13]thia[1,14] diazatetracyclo [14.7.2.0~3,6~.0~19,24~] pentacosa[8,16,18,24]tetraen]- 15''''-one 13'''',13''''-dioxide