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

Systemtic Name: 2-[(2-bromophenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(2-bromo-N-methylsulfonyl-anilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(2-bromo-N-methylsulfonylanilino)-N-[3-(4-methyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(2-bromo-N-methylsulfonylanilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(2-bromo-N-mesyl-anilino)-N-[3-(4-methylpiperazino)propyl]acetamide Formula: C17H27BrN4O3S MolecularWeight: 447.39028

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)CN(C2=CC=CC=C2Br)S(=O)(=O)C

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)CN(C2=CC=CC=C2Br)S(=O)(=O)C

InChI

InChI=1S/C17H27BrN4O3S/c1-20-10-12-21(13-11-20)9-5-8-19-17(23)14-22(26(2,24)25)16-7-4-3-6-15(16)18/h3-4,6-7H,5,8-14H2,1-2H3,(H,19,23)