2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(3-fluoranyl-4-methyl-phenyl)propanamide

Systemtic Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(3-fluoranyl-4-methyl-phenyl)propanamide Openeye Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(3-fluoro-4-methyl-phenyl)propanamide CAS Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-(3-fluoro-4-methylphenyl)propanamide IUPAC Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(3-fluoro-4-methylphenyl)propanamide Traditional Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-(3-fluoro-4-methyl-phenyl)propionamide Formula: C18H17FN2OS2 MolecularWeight: 360.468783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3CS2)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3CS2)F

InChI

InChI=1S/C18H17FN2OS2/c1-11-7-8-14(9-15(11)19)20-17(22)12(2)24-18-21-16-6-4-3-5-13(16)10-23-18/h3-9,12H,10H2,1-2H3,(H,20,22)