5-ethyl-3-morpholin-4-ylcarbonyl-11-oxidanylidene-benzo[b][1,4]benzothiazepin-6-one

Systemtic Name: 5-ethyl-3-morpholin-4-ylcarbonyl-11-oxidanylidene-benzo[b][1,4]benzothiazepin-6-one Openeye Name: 5-ethyl-3-(morpholine-4-carbonyl)-11-oxo-benzo[b][1,4]benzothiazepin-6-one CAS Name: 5-ethyl-3-[4-morpholinyl(oxo)methyl]-11-oxo-6-benzo[b][1,4]benzothiazepinone IUPAC Name: 5-ethyl-3-(morpholine-4-carbonyl)-11-oxobenzo[b][1,4]benzothiazepin-6-one Traditional Name: 5-ethyl-11-keto-3-(morpholine-4-carbonyl)benzo[b][1,4]benzothiazepin-6-one Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C(=O)N3CCOCC3)S(=O)C4=CC=CC=C4C1=O

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C(=O)N3CCOCC3)S(=O)C4=CC=CC=C4C1=O

InChI

InChI=1S/C20H20N2O4S/c1-2-22-16-13-14(19(23)21-9-11-26-12-10-21)7-8-18(16)27(25)17-6-4-3-5-15(17)20(22)24/h3-8,13H,2,9-12H2,1H3