[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 1,3-benzothiazole-6-carboxylate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C17H13FN2O3S MolecularWeight: 344.360123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)COC(=O)C2=CC3=C(C=C2)N=CS3)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)COC(=O)C2=CC3=C(C=C2)N=CS3)F

InChI

InChI=1S/C17H13FN2O3S/c18-13-4-1-11(2-5-13)8-19-16(21)9-23-17(22)12-3-6-14-15(7-12)24-10-20-14/h1-7,10H,8-9H2,(H,19,21)