2-[4-[2-(2,5-dimethylphenyl)sulfonylethyl]piperazin-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-[2-(2,5-dimethylphenyl)sulfonylethyl]piperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[2-(2,5-dimethylphenyl)sulfonylethyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[2-(2,5-dimethylphenyl)sulfonylethyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-[2-(2,5-dimethylphenyl)sulfonylethyl]piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[2-(2,5-dimethylphenyl)sulfonylethyl]piperazino]acetamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)CCN2CCN(CC2)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)CCN2CCN(CC2)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S/c1-19-8-9-20(2)22(16-19)30(28,29)15-14-25-10-12-26(13-11-25)18-23(27)24-17-21-6-4-3-5-7-21/h3-9,16H,10-15,17-18H2,1-2H3,(H,24,27)