2-[(2,6-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide

Systemtic Name: 2-[(2,6-dimethylphenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(2,6-dimethyl-N-methylsulfonyl-anilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(2,6-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(2,6-dimethyl-N-methylsulfonylanilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(N-mesyl-2,6-dimethyl-anilino)-N-[3-(4-methylpiperazino)propyl]acetamide Formula: C19H32N4O3S MolecularWeight: 396.54738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32N4O3S/c1-16-7-5-8-17(2)19(16)23(27(4,25)26)15-18(24)20-9-6-10-22-13-11-21(3)12-14-22/h5,7-8H,6,9-15H2,1-4H3,(H,20,24)