2-(4-fluoranylphenoxy)-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)ethanamide

Systemtic Name: 2-(4-fluoranylphenoxy)-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)ethanamide Openeye Name: 2-(4-fluorophenoxy)-N-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-3-yl)acetamide CAS Name: 2-(4-fluorophenoxy)-N-(5-methyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)acetamide IUPAC Name: 2-(4-fluorophenoxy)-N-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-3-yl)acetamide Traditional Name: 2-(4-fluorophenoxy)-N-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-3-yl)acetamide Formula: C22H17FN2O3S MolecularWeight: 408.445383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)NC(=O)COC3=CC=C(C=C3)F)SC4=CC=CC=C4C1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)NC(=O)COC3=CC=C(C=C3)F)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C22H17FN2O3S/c1-25-18-12-15(24-21(26)13-28-16-9-6-14(23)7-10-16)8-11-20(18)29-19-5-3-2-4-17(19)22(25)27/h2-12H,13H2,1H3,(H,24,26)