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

Systemtic Name: 2-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)acetamide CAS Name: 2-(6-oxo-5-pyrido[2,3-b][1,4]benzothiazepinyl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)acetamide Traditional Name: N-benzyl-2-(6-ketopyrido[2,3-b][1,4]benzothiazepin-5-yl)acetamide Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

InChI

InChI=1S/C21H17N3O2S/c25-19(23-13-15-7-2-1-3-8-15)14-24-17-10-6-12-22-20(17)27-18-11-5-4-9-16(18)21(24)26/h1-12H,13-14H2,(H,23,25)