4-butoxy-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-butoxy-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]benzenesulfonamide Openeye Name: 4-butoxy-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]benzenesulfonamide CAS Name: 4-butoxy-N-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]benzenesulfonamide IUPAC Name: 4-butoxy-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]benzenesulfonamide Traditional Name: 4-butoxy-N-[4-methoxy-3-(4-methylpiperazino)phenyl]benzenesulfonamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)OC)N3CCN(CC3)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)OC)N3CCN(CC3)C

InChI

InChI=1S/C22H31N3O4S/c1-4-5-16-29-19-7-9-20(10-8-19)30(26,27)23-18-6-11-22(28-3)21(17-18)25-14-12-24(2)13-15-25/h6-11,17,23H,4-5,12-16H2,1-3H3