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

Systemtic Name: 4-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-propyl-butanamide Openeye Name: 4-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-propyl-butanamide CAS Name: 4-(6-oxo-5-pyrido[2,3-b][1,4]benzothiazepinyl)-N-propylbutanamide IUPAC Name: 4-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-propylbutanamide Traditional Name: 4-(6-ketopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-propyl-butyramide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O2S/c1-2-11-20-17(23)10-6-13-22-15-8-5-12-21-18(15)25-16-9-4-3-7-14(16)19(22)24/h3-5,7-9,12H,2,6,10-11,13H2,1H3,(H,20,23)