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

Systemtic Name: N-(2-methoxyethyl)-4-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)butanamide Openeye Name: N-(2-methoxyethyl)-4-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)butanamide CAS Name: N-(2-methoxyethyl)-4-(6-oxo-5-pyrido[2,3-b][1,4]benzothiazepinyl)butanamide IUPAC Name: N-(2-methoxyethyl)-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-(2-methoxyethyl)butyramide Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O3S/c1-25-13-11-20-17(23)9-5-12-22-15-7-4-10-21-18(15)26-16-8-3-2-6-14(16)19(22)24/h2-4,6-8,10H,5,9,11-13H2,1H3,(H,20,23)