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

Systemtic Name: 2-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-(5-oxo-6-pyrido[2,3-b][1,5]benzothiazepinyl)-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: 2-(5-ketopyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-[2-(2-thienyl)ethyl]acetamide Formula: C20H17N3O2S2 MolecularWeight: 395.49788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)C3=C(S2)N=CC=C3)CC(=O)NCCC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)C3=C(S2)N=CC=C3)CC(=O)NCCC4=CC=CS4

InChI

InChI=1S/C20H17N3O2S2/c24-18(21-11-9-14-5-4-12-26-14)13-23-16-7-1-2-8-17(16)27-19-15(20(23)25)6-3-10-22-19/h1-8,10,12H,9,11,13H2,(H,21,24)