N-[[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-[[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[[4-[(4-ethyl-1-piperazinyl)methyl]phenyl]methyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[4-[(4-ethylpiperazino)methyl]benzyl]-3,4-dimethoxy-benzenesulfonamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=CC=C(C=C2)CNS(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN1CCN(CC1)CC2=CC=C(C=C2)CNS(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H31N3O4S/c1-4-24-11-13-25(14-12-24)17-19-7-5-18(6-8-19)16-23-30(26,27)20-9-10-21(28-2)22(15-20)29-3/h5-10,15,23H,4,11-14,16-17H2,1-3H3