2-[4-[3-(4-butylsulfinylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-(2,6-diethoxyphenyl)ethanamide

Systemtic Name: 2-[4-[3-(4-butylsulfinylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-(2,6-diethoxyphenyl)ethanamide Openeye Name: 2-[4-[3-(4-butylsulfinylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]-N-(2,6-diethoxyphenyl)acetamide CAS Name: 2-[4-[3-(4-butylsulfinylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-N-(2,6-diethoxyphenyl)acetamide IUPAC Name: 2-[4-[3-(4-butylsulfinylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-N-(2,6-diethoxyphenyl)acetamide Traditional Name: 2-[4-[3-(4-butylsulfinylphenoxy)-2-hydroxy-propyl]piperazino]-N-(2,6-diethoxyphenyl)acetamide Formula: C29H43N3O6S MolecularWeight: 561.73322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)CC(=O)NC3=C(C=CC=C3OCC)OCC)O

Isomeric SMILES

CCCCS(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)CC(=O)NC3=C(C=CC=C3OCC)OCC)O

InChI

InChI=1S/C29H43N3O6S/c1-4-7-19-39(35)25-13-11-24(12-14-25)38-22-23(33)20-31-15-17-32(18-16-31)21-28(34)30-29-26(36-5-2)9-8-10-27(29)37-6-3/h8-14,23,33H,4-7,15-22H2,1-3H3,(H,30,34)