Chemical Compound

SCHEMBL21040594

SCHEMBL21040594 chemical structure
Primary Record

SCHEMBL21040594

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
140924489
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]1CCOC)(CN7CCN(CC7)C(C)(C)C)OC
Canonical SMILES
COCC[C@@H]1[C@@H](C)C/C=C/[C@@](CN2CCN(C(C)(C)C)CC2)(OC)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc43)COc3ccc(cc32)C(=O)NS1(=O)=O

Names & Synonyms

  • SCHEMBL21040594
  • BDBM470802
  • US10821115, Example 189
  • (1S,3''R,6''R,7''R,8''E,11''S,12''R)- 7''-((4-tert-butyl-1- piperazinyl)methyl)-6-chloro- 7''-methoxy-12''-(2- methoxyethyl)-11''-methyl-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