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

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

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCCN1C2=C(N=CC=C2)SC3=CC=CC=C3C1=O

Isomeric SMILES

CNC(=O)CCCN1C2=C(N=CC=C2)SC3=CC=CC=C3C1=O

InChI

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