ethyl 2-[4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate Openeye Name: ethyl 2-[4-[(4-bromo-2-fluoro-phenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[4-[(4-bromo-2-fluorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(4-bromo-2-fluorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[4-(4-bromo-2-fluoro-benzyl)-3-keto-1,4-benzothiazin-2-yl]acetic acid ethyl ester Formula: C19H17BrFNO3S MolecularWeight: 438.310583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)N(C2=CC=CC=C2S1)CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCOC(=O)CC1C(=O)N(C2=CC=CC=C2S1)CC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C19H17BrFNO3S/c1-2-25-18(23)10-17-19(24)22(15-5-3-4-6-16(15)26-17)11-12-7-8-13(20)9-14(12)21/h3-9,17H,2,10-11H2,1H3