2-fluoranyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)benzamide

Systemtic Name: 2-fluoranyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)benzamide Openeye Name: 2-fluoro-N-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-3-yl)benzamide CAS Name: 2-fluoro-N-(5-methyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)benzamide IUPAC Name: 2-fluoro-N-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-3-yl)benzamide Traditional Name: 2-fluoro-N-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-3-yl)benzamide Formula: C21H15FN2O2S MolecularWeight: 378.419403

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3F)SC4=CC=CC=C4C1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3F)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C21H15FN2O2S/c1-24-17-12-13(23-20(25)14-6-2-4-8-16(14)22)10-11-19(17)27-18-9-5-3-7-15(18)21(24)26/h2-12H,1H3,(H,23,25)