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

Systemtic Name: N-(3-methoxypropyl)-4-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)butanamide Openeye Name: N-(3-methoxypropyl)-4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)butanamide CAS Name: N-(3-methoxypropyl)-4-(5-oxo-6-pyrido[2,3-b][1,5]benzothiazepinyl)butanamide IUPAC Name: N-(3-methoxypropyl)-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-(3-methoxypropyl)butyramide Formula: C20H23N3O3S MolecularWeight: 385.47992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O3S/c1-26-14-6-12-21-18(24)10-5-13-23-16-8-2-3-9-17(16)27-19-15(20(23)25)7-4-11-22-19/h2-4,7-9,11H,5-6,10,12-14H2,1H3,(H,21,24)