2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperidin-1-yl)propyl]ethanamide

Systemtic Name: 2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperidin-1-yl)propyl]ethanamide Openeye Name: 2-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[3-(4-methyl-1-piperidyl)propyl]acetamide CAS Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methyl-1-piperidinyl)propyl]acetamide IUPAC Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methylpiperidin-1-yl)propyl]acetamide Traditional Name: 2-(N-mesyl-2,5-dimethyl-anilino)-N-[3-(4-methylpiperidino)propyl]acetamide Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CCCNC(=O)CN(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CC1CCN(CC1)CCCNC(=O)CN(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C20H33N3O3S/c1-16-8-12-22(13-9-16)11-5-10-21-20(24)15-23(27(4,25)26)19-14-17(2)6-7-18(19)3/h6-7,14,16H,5,8-13,15H2,1-4H3,(H,21,24)