2-(3,4-dimethylphenoxy)-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(3,4-dimethylphenoxy)-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(3,4-dimethylphenoxy)-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-(3,4-dimethylphenoxy)-N-[2-(4-methylsulfonyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(3,4-dimethylphenoxy)-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-(3,4-dimethylphenoxy)-N-[2-(4-mesylpiperazino)phenyl]acetamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NC2=CC=CC=C2N3CCN(CC3)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)NC2=CC=CC=C2N3CCN(CC3)S(=O)(=O)C)C

InChI

InChI=1S/C21H27N3O4S/c1-16-8-9-18(14-17(16)2)28-15-21(25)22-19-6-4-5-7-20(19)23-10-12-24(13-11-23)29(3,26)27/h4-9,14H,10-13,15H2,1-3H3,(H,22,25)