2-[4-[3-(2-methoxyphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-(4-methylsulfinylphenyl)ethanamide

Systemtic Name: 2-[4-[3-(2-methoxyphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-(4-methylsulfinylphenyl)ethanamide Openeye Name: 2-[4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl]-N-(4-methylsulfinylphenyl)acetamide CAS Name: 2-[4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1-piperazinyl]-N-(4-methylsulfinylphenyl)acetamide IUPAC Name: 2-[4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl]-N-(4-methylsulfinylphenyl)acetamide Traditional Name: 2-[4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazino]-N-(4-methylsulfinylphenyl)acetamide Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC(CN2CCN(CC2)CC(=O)NC3=CC=C(C=C3)S(=O)C)O

Isomeric SMILES

COC1=CC=CC=C1OCC(CN2CCN(CC2)CC(=O)NC3=CC=C(C=C3)S(=O)C)O

InChI

InChI=1S/C23H31N3O5S/c1-30-21-5-3-4-6-22(21)31-17-19(27)15-25-11-13-26(14-12-25)16-23(28)24-18-7-9-20(10-8-18)32(2)29/h3-10,19,27H,11-17H2,1-2H3,(H,24,28)