N-(2,5-dimethoxyphenyl)-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: N-(2,5-dimethoxyphenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxo-ethyl]benzenesulfonamide CAS Name: N-(2,5-dimethoxyphenyl)-N-[2-(4-formyl-1-piperazinyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: N-(2,5-dimethoxyphenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: N-(2,5-dimethoxyphenyl)-N-[2-(4-formylpiperazino)-2-keto-ethyl]benzenesulfonamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N(CC(=O)N2CCN(CC2)C=O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N(CC(=O)N2CCN(CC2)C=O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O6S/c1-29-17-8-9-20(30-2)19(14-17)24(31(27,28)18-6-4-3-5-7-18)15-21(26)23-12-10-22(16-25)11-13-23/h3-9,14,16H,10-13,15H2,1-2H3