N-[(4-methylphenyl)methyl]-2-(4-octylsulfonylpiperazin-2-yl)ethanamide

Systemtic Name: N-[(4-methylphenyl)methyl]-2-(4-octylsulfonylpiperazin-2-yl)ethanamide Openeye Name: 2-(4-octylsulfonylpiperazin-2-yl)-N-(p-tolylmethyl)acetamide CAS Name: N-[(4-methylphenyl)methyl]-2-(4-octylsulfonyl-2-piperazinyl)acetamide IUPAC Name: N-[(4-methylphenyl)methyl]-2-(4-octylsulfonylpiperazin-2-yl)acetamide Traditional Name: N-(4-methylbenzyl)-2-(4-octylsulfonylpiperazin-2-yl)acetamide Formula: C22H37N3O3S MolecularWeight: 423.61248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N1CCNC(C1)CC(=O)NCC2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCS(=O)(=O)N1CCNC(C1)CC(=O)NCC2=CC=C(C=C2)C

InChI

InChI=1S/C22H37N3O3S/c1-3-4-5-6-7-8-15-29(27,28)25-14-13-23-21(18-25)16-22(26)24-17-20-11-9-19(2)10-12-20/h9-12,21,23H,3-8,13-18H2,1-2H3,(H,24,26)