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

Systemtic Name: N-methyl-4-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)butanamide Openeye Name: N-methyl-4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)butanamide CAS Name: N-methyl-4-(5-oxo-6-pyrido[2,3-b][1,5]benzothiazepinyl)butanamide IUPAC Name: N-methyl-4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)butanamide Traditional Name: 4-(5-ketopyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-methyl-butyramide Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCCN1C2=CC=CC=C2SC3=C(C1=O)C=CC=N3

Isomeric SMILES

CNC(=O)CCCN1C2=CC=CC=C2SC3=C(C1=O)C=CC=N3

InChI

InChI=1S/C17H17N3O2S/c1-18-15(21)9-5-11-20-13-7-2-3-8-14(13)23-16-12(17(20)22)6-4-10-19-16/h2-4,6-8,10H,5,9,11H2,1H3,(H,18,21)