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

Systemtic Name: 2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(N-mesyl-2,5-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(=C(C=C1)C)N(CC(=O)NCCCN2CCN(CC2)C)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C19H32N4O3S/c1-16-6-7-17(2)18(14-16)23(27(4,25)26)15-19(24)20-8-5-9-22-12-10-21(3)11-13-22/h6-7,14H,5,8-13,15H2,1-4H3,(H,20,24)