methyl 2-[6-methyl-2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfonylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-methyl-2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfonylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-methyl-2-[2-[2-oxo-2-(1-piperidyl)ethyl]sulfonylacetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-methyl-2-[1-oxo-2-[2-oxo-2-(1-piperidinyl)ethyl]sulfonylethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-methyl-2-[2-(2-oxo-2-piperidin-1-ylethyl)sulfonylacetyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-(2-keto-2-piperidino-ethyl)sulfonylacetyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C20H25N3O6S2 MolecularWeight: 467.559

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)N3CCCCC3)S2)CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)N3CCCCC3)S2)CC(=O)OC

InChI

InChI=1S/C20H25N3O6S2/c1-14-6-7-15-16(10-14)30-20(23(15)11-19(26)29-2)21-17(24)12-31(27,28)13-18(25)22-8-4-3-5-9-22/h6-7,10H,3-5,8-9,11-13H2,1-2H3