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

Systemtic Name: N-butyl-4-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)butanamide Openeye Name: N-butyl-4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)butanamide CAS Name: N-butyl-4-(5-oxo-6-pyrido[2,3-b][1,5]benzothiazepinyl)butanamide IUPAC Name: N-butyl-4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)butanamide Traditional Name: N-butyl-4-(5-ketopyrido[2,3-b][1,5]benzothiazepin-6-yl)butyramide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O2S/c1-2-3-12-21-18(24)11-7-14-23-16-9-4-5-10-17(16)26-19-15(20(23)25)8-6-13-22-19/h4-6,8-10,13H,2-3,7,11-12,14H2,1H3,(H,21,24)