[4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenyl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenyl] 1,3-benzothiazole-6-carboxylate Openeye Name: [4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [4-[(4-fluorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(4-fluorophenyl)sulfonyl-methylamino]phenyl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C21H15FN2O4S2 MolecularWeight: 442.483203

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)N=CS3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CN(C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)N=CS3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H15FN2O4S2/c1-24(30(26,27)18-9-3-15(22)4-10-18)16-5-7-17(8-6-16)28-21(25)14-2-11-19-20(12-14)29-13-23-19/h2-13H,1H3