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

Systemtic Name: 2-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-(6-oxo-5-pyrido[2,3-b][1,4]benzothiazepinyl)-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: 2-(6-ketopyrido[2,3-b][1,4]benzothiazepin-5-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)C(=O)N(C3=C(S2)N=CC=C3)CC(=O)NCCC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(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)13-23-16-7-3-10-22-19(16)27-17-8-2-1-6-15(17)20(23)25/h1-8,10,12H,9,11,13H2,(H,21,24)