methyl 2-[(2Z)-4-fluoranyl-2-thiophen-2-ylsulfonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(2Z)-4-fluoranyl-2-thiophen-2-ylsulfonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[(2Z)-4-fluoro-2-(2-thienylsulfonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-4-fluoro-2-thiophen-2-ylsulfonylimino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2Z)-4-fluoro-2-thiophen-2-ylsulfonylimino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-4-fluoro-2-(2-thienylsulfonylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C14H11FN2O4S3 MolecularWeight: 386.441543

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=CC=C2SC1=NS(=O)(=O)C3=CC=CS3)F

Isomeric SMILES

COC(=O)CN\1C2=C(C=CC=C2S/C1=N\S(=O)(=O)C3=CC=CS3)F

InChI

InChI=1S/C14H11FN2O4S3/c1-21-11(18)8-17-13-9(15)4-2-5-10(13)23-14(17)16-24(19,20)12-6-3-7-22-12/h2-7H,8H2,1H3/b16-14-