N-[[4-(3,5-dimethoxyphenyl)piperazin-2-yl]methyl]-4-(ethylsulfonylamino)benzenesulfonamide

Systemtic Name: N-[[4-(3,5-dimethoxyphenyl)piperazin-2-yl]methyl]-4-(ethylsulfonylamino)benzenesulfonamide Openeye Name: N-[[4-(3,5-dimethoxyphenyl)piperazin-2-yl]methyl]-4-(ethylsulfonylamino)benzenesulfonamide CAS Name: N-[[4-(3,5-dimethoxyphenyl)-2-piperazinyl]methyl]-4-(ethylsulfonylamino)benzenesulfonamide IUPAC Name: N-[[4-(3,5-dimethoxyphenyl)piperazin-2-yl]methyl]-4-(ethylsulfonylamino)benzenesulfonamide Traditional Name: N-[[4-(3,5-dimethoxyphenyl)piperazin-2-yl]methyl]-4-(esylamino)benzenesulfonamide Formula: C21H30N4O6S2 MolecularWeight: 498.6161

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2CN(CCN2)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CCS(=O)(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2CN(CCN2)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C21H30N4O6S2/c1-4-32(26,27)24-16-5-7-21(8-6-16)33(28,29)23-14-17-15-25(10-9-22-17)18-11-19(30-2)13-20(12-18)31-3/h5-8,11-13,17,22-24H,4,9-10,14-15H2,1-3H3