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

Systemtic Name: N-(2-methoxyphenyl)-2-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)ethanamide Openeye Name: N-(2-methoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)acetamide CAS Name: N-(2-methoxyphenyl)-2-(5-oxo-6-pyrido[2,3-b][1,5]benzothiazepinyl)acetamide IUPAC Name: N-(2-methoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)acetamide Traditional Name: 2-(5-ketopyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-(2-methoxyphenyl)acetamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CN2C3=CC=CC=C3SC4=C(C2=O)C=CC=N4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CN2C3=CC=CC=C3SC4=C(C2=O)C=CC=N4

InChI

InChI=1S/C21H17N3O3S/c1-27-17-10-4-2-8-15(17)23-19(25)13-24-16-9-3-5-11-18(16)28-20-14(21(24)26)7-6-12-22-20/h2-12H,13H2,1H3,(H,23,25)