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

Systemtic Name: 2-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-(5-oxo-6-pyrido[2,3-b][1,5]benzothiazepinyl)-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(5-ketopyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-(3-pyrrolidinopropyl)acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC(=O)CN2C3=CC=CC=C3SC4=C(C2=O)C=CC=N4

Isomeric SMILES

C1CCN(C1)CCCNC(=O)CN2C3=CC=CC=C3SC4=C(C2=O)C=CC=N4

InChI

InChI=1S/C21H24N4O2S/c26-19(22-11-6-14-24-12-3-4-13-24)15-25-17-8-1-2-9-18(17)28-20-16(21(25)27)7-5-10-23-20/h1-2,5,7-10H,3-4,6,11-15H2,(H,22,26)