2-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(3-piperidin-1-ylpropyl)ethanamide

Systemtic Name: 2-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(3-piperidin-1-ylpropyl)ethanamide Openeye Name: 2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-[3-(1-piperidyl)propyl]acetamide CAS Name: 2-(6-oxo-5-pyrido[2,3-b][1,4]benzothiazepinyl)-N-[3-(1-piperidinyl)propyl]acetamide IUPAC Name: 2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(3-piperidin-1-ylpropyl)acetamide Traditional Name: 2-(6-ketopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(3-piperidinopropyl)acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC(=O)CN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

Isomeric SMILES

C1CCN(CC1)CCCNC(=O)CN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

InChI

InChI=1S/C22H26N4O2S/c27-20(23-12-7-15-25-13-4-1-5-14-25)16-26-18-9-6-11-24-21(18)29-19-10-3-2-8-17(19)22(26)28/h2-3,6,8-11H,1,4-5,7,12-16H2,(H,23,27)