5-bromanyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-2-yl)furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-2-yl)furan-2-carboxamide Openeye Name: 5-bromo-N-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-2-yl)furan-2-carboxamide CAS Name: 5-bromo-N-(5-methyl-6-oxo-2-benzo[b][1,4]benzothiazepinyl)-2-furancarboxamide IUPAC Name: 5-bromo-N-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-2-yl)furan-2-carboxamide Traditional Name: 5-bromo-N-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-2-yl)-2-furamide Formula: C19H13BrN2O3S MolecularWeight: 429.28712

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(O3)Br)SC4=CC=CC=C4C1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(O3)Br)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C19H13BrN2O3S/c1-22-13-7-6-11(21-18(23)14-8-9-17(20)25-14)10-16(13)26-15-5-3-2-4-12(15)19(22)24/h2-10H,1H3,(H,21,23)