methyl 3-[2-[2-(4-fluorophenyl)sulfanylethanoylimino]-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: methyl 3-[2-[2-(4-fluorophenyl)sulfanylethanoylimino]-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[2-[2-(4-fluorophenyl)sulfanylacetyl]imino-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[2-[(4-fluorophenyl)thio]-1-oxoethyl]imino-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[2-(4-fluorophenyl)sulfanylacetyl]imino-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-[2-[(4-fluorophenyl)thio]acetyl]imino-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C19H17FN2O3S2 MolecularWeight: 404.478283

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)CSC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)CSC3=CC=C(C=C3)F

InChI

InChI=1S/C19H17FN2O3S2/c1-25-18(24)10-11-22-15-4-2-3-5-16(15)27-19(22)21-17(23)12-26-14-8-6-13(20)7-9-14/h2-9H,10-12H2,1H3