N-(4-bromanyl-2-methyl-phenyl)-2-[methyl-[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[methyl-[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]amino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[methyl-[3-oxo-3-[4-(2-pyridyl)piperazin-1-yl]propyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[methyl-[3-oxo-3-[4-(2-pyridinyl)-1-piperazinyl]propyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[methyl-[3-oxo-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[3-keto-3-[4-(2-pyridyl)piperazino]propyl]-methyl-amino]acetamide Formula: C22H28BrN5O2 MolecularWeight: 474.39402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)CCC(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)CCC(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C22H28BrN5O2/c1-17-15-18(23)6-7-19(17)25-21(29)16-26(2)10-8-22(30)28-13-11-27(12-14-28)20-5-3-4-9-24-20/h3-7,9,15H,8,10-14,16H2,1-2H3,(H,25,29)