1,3-benzothiazol-2-ylmethyl 2-[4-[methyl(naphthalen-2-ylsulfonyl)amino]phenoxy]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[4-[methyl(naphthalen-2-ylsulfonyl)amino]phenoxy]ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[4-[methyl(2-naphthylsulfonyl)amino]phenoxy]acetate CAS Name: 2-[4-[methyl(2-naphthalenylsulfonyl)amino]phenoxy]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[4-[methyl(naphthalen-2-ylsulfonyl)amino]phenoxy]acetate Traditional Name: 2-[4-[methyl(2-naphthylsulfonyl)amino]phenoxy]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C27H22N2O5S2 MolecularWeight: 518.60398

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC(=O)OCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC(=O)OCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H22N2O5S2/c1-29(36(31,32)23-15-10-19-6-2-3-7-20(19)16-23)21-11-13-22(14-12-21)33-18-27(30)34-17-26-28-24-8-4-5-9-25(24)35-26/h2-16H,17-18H2,1H3