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

Systemtic Name: 2-[(3-methylphenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(3-methyl-N-methylsulfonyl-anilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(3-methyl-N-methylsulfonylanilino)-N-[3-(4-methyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(3-methyl-N-methylsulfonylanilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(N-mesyl-3-methyl-anilino)-N-[3-(4-methylpiperazino)propyl]acetamide Formula: C18H30N4O3S MolecularWeight: 382.5208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N4O3S/c1-16-6-4-7-17(14-16)22(26(3,24)25)15-18(23)19-8-5-9-21-12-10-20(2)11-13-21/h4,6-7,14H,5,8-13,15H2,1-3H3,(H,19,23)