ethyl 2-[4-[2-[(3-fluorophenyl)amino]-2-sulfanylidene-ethyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[4-[2-[(3-fluorophenyl)amino]-2-sulfanylidene-ethyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate Openeye Name: ethyl 2-[4-[2-(3-fluoroanilino)-2-thioxo-ethyl]-3-oxo-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[4-[2-(3-fluoroanilino)-2-sulfanylideneethyl]-3-oxo-1,4-benzothiazin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-(3-fluoroanilino)-2-sulfanylideneethyl]-3-oxo-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[4-[2-(3-fluoroanilino)-2-thioxo-ethyl]-3-keto-1,4-benzothiazin-2-yl]acetic acid ethyl ester Formula: C20H19FN2O3S2 MolecularWeight: 418.504863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)N(C2=CC=CC=C2S1)CC(=S)NC3=CC(=CC=C3)F

Isomeric SMILES

CCOC(=O)CC1C(=O)N(C2=CC=CC=C2S1)CC(=S)NC3=CC(=CC=C3)F

InChI

InChI=1S/C20H19FN2O3S2/c1-2-26-19(24)11-17-20(25)23(15-8-3-4-9-16(15)28-17)12-18(27)22-14-7-5-6-13(21)10-14/h3-10,17H,2,11-12H2,1H3,(H,22,27)