N-cyclooctyl-2-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)ethanamide

Systemtic Name: N-cyclooctyl-2-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)ethanamide Openeye Name: N-cyclooctyl-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)acetamide CAS Name: N-cyclooctyl-2-(5-oxo-6-pyrido[2,3-b][1,5]benzothiazepinyl)acetamide IUPAC Name: N-cyclooctyl-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)acetamide Traditional Name: N-cyclooctyl-2-(5-ketopyrido[2,3-b][1,5]benzothiazepin-6-yl)acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CN2C3=CC=CC=C3SC4=C(C2=O)C=CC=N4

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CN2C3=CC=CC=C3SC4=C(C2=O)C=CC=N4

InChI

InChI=1S/C22H25N3O2S/c26-20(24-16-9-4-2-1-3-5-10-16)15-25-18-12-6-7-13-19(18)28-21-17(22(25)27)11-8-14-23-21/h6-8,11-14,16H,1-5,9-10,15H2,(H,24,26)