methyl 3-methyl-2-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfonylethanoylimino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-methyl-2-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfonylethanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-methyl-2-[2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-methyl-2-[1-oxo-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]sulfonylethyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-methyl-2-[2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[2-(2-keto-2-pyrrolidino-ethyl)sulfonylacetyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C18H21N3O6S2 MolecularWeight: 439.50584

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCC3

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCC3

InChI

InChI=1S/C18H21N3O6S2/c1-20-13-6-5-12(17(24)27-2)9-14(13)28-18(20)19-15(22)10-29(25,26)11-16(23)21-7-3-4-8-21/h5-6,9H,3-4,7-8,10-11H2,1-2H3