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

Systemtic Name: 3-fluoranyl-4-methyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)benzamide Openeye Name: 3-fluoro-4-methyl-N-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-3-yl)benzamide CAS Name: 3-fluoro-4-methyl-N-(5-methyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)benzamide IUPAC Name: 3-fluoro-4-methyl-N-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-3-yl)benzamide Traditional Name: 3-fluoro-N-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-3-yl)-4-methyl-benzamide Formula: C22H17FN2O2S MolecularWeight: 392.445983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)SC4=CC=CC=C4C(=O)N3C)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)SC4=CC=CC=C4C(=O)N3C)F

InChI

InChI=1S/C22H17FN2O2S/c1-13-7-8-14(11-17(13)23)21(26)24-15-9-10-20-18(12-15)25(2)22(27)16-5-3-4-6-19(16)28-20/h3-12H,1-2H3,(H,24,26)