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

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-[3-(4-methylpiperazino)propyl]acetamide Formula: C19H32N4O3S MolecularWeight: 396.54738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CC(=O)NCCCN2CCN(CC2)C)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CC(=O)NCCCN2CCN(CC2)C)S(=O)(=O)C)C

InChI

InChI=1S/C19H32N4O3S/c1-16-12-17(2)14-18(13-16)23(27(4,25)26)15-19(24)20-6-5-7-22-10-8-21(3)9-11-22/h12-14H,5-11,15H2,1-4H3,(H,20,24)