3-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanoyl-(4-fluorophenyl)amino]propanamide

Systemtic Name: 3-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanoyl-(4-fluorophenyl)amino]propanamide Openeye Name: 3-(N-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]-4-fluoro-anilino)propanamide CAS Name: 3-(N-[2-(4H-3,1-benzothiazin-2-ylthio)-1-oxoethyl]-4-fluoroanilino)propanamide IUPAC Name: 3-(N-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]-4-fluoroanilino)propanamide Traditional Name: 3-(N-[2-(4H-3,1-benzothiazin-2-ylthio)acetyl]-4-fluoro-anilino)propionamide Formula: C19H18FN3O2S2 MolecularWeight: 403.493523

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N=C(S1)SCC(=O)N(CCC(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

C1C2=CC=CC=C2N=C(S1)SCC(=O)N(CCC(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H18FN3O2S2/c20-14-5-7-15(8-6-14)23(10-9-17(21)24)18(25)12-27-19-22-16-4-2-1-3-13(16)11-26-19/h1-8H,9-12H2,(H2,21,24)