5-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentanoyl]-2-methylsulfinyl-benzenesulfonamide

Systemtic Name: 5-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentanoyl]-2-methylsulfinyl-benzenesulfonamide Openeye Name: 5-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentanoyl]-2-methylsulfinyl-benzenesulfonamide CAS Name: 5-[5-[4-(2-methoxyphenyl)-1-piperazinyl]-1-oxopentyl]-2-methylsulfinylbenzenesulfonamide IUPAC Name: 5-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentanoyl]-2-methylsulfinylbenzenesulfonamide Traditional Name: 5-[5-[4-(2-methoxyphenyl)piperazino]pentanoyl]-2-methylsulfinyl-benzenesulfonamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCC(=O)C3=CC(=C(C=C3)S(=O)C)S(=O)(=O)N

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCC(=O)C3=CC(=C(C=C3)S(=O)C)S(=O)(=O)N

InChI

InChI=1S/C23H31N3O5S2/c1-31-21-9-4-3-7-19(21)26-15-13-25(14-16-26)12-6-5-8-20(27)18-10-11-22(32(2)28)23(17-18)33(24,29)30/h3-4,7,9-11,17H,5-6,8,12-16H2,1-2H3,(H2,24,29,30)