[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-fluorophenyl)methoxy]benzoate

Systemtic Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-fluorophenyl)methoxy]benzoate Openeye Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl] 2-[(4-fluorophenyl)methoxy]benzoate CAS Name: 2-[(4-fluorophenyl)methoxy]benzoic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] 2-[(4-fluorophenyl)methoxy]benzoate Traditional Name: 2-(4-fluorobenzyl)oxybenzoic acid [2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl] ester Formula: C23H17FN2O4S MolecularWeight: 436.455483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=NC3=CC=CC=C3S2)OCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=NC3=CC=CC=C3S2)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C23H17FN2O4S/c24-16-11-9-15(10-12-16)13-29-19-7-3-1-5-17(19)22(28)30-14-21(27)26-23-25-18-6-2-4-8-20(18)31-23/h1-12H,13-14H2,(H,25,26,27)