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

Systemtic Name: N-(2,5-dimethylphenyl)-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: N-(2,5-dimethylphenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxo-ethyl]benzenesulfonamide CAS Name: N-(2,5-dimethylphenyl)-N-[2-(4-formyl-1-piperazinyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: N-(2,5-dimethylphenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: N-(2,5-dimethylphenyl)-N-[2-(4-formylpiperazino)-2-keto-ethyl]benzenesulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CC(=O)N2CCN(CC2)C=O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CC(=O)N2CCN(CC2)C=O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O4S/c1-17-8-9-18(2)20(14-17)24(29(27,28)19-6-4-3-5-7-19)15-21(26)23-12-10-22(16-25)11-13-23/h3-9,14,16H,10-13,15H2,1-2H3