N'-(5-bromanyl-2-cyano-pyrimidin-4-yl)-N'-cyclopentyl-4-[[4-(4-methylpiperazin-1-yl)piperidin-1-yl]methyl]benzohydrazide

Systemtic Name: N'-(5-bromanyl-2-cyano-pyrimidin-4-yl)-N'-cyclopentyl-4-[[4-(4-methylpiperazin-1-yl)piperidin-1-yl]methyl]benzohydrazide Openeye Name: N'-(5-bromo-2-cyano-pyrimidin-4-yl)-N'-cyclopentyl-4-[[4-(4-methylpiperazin-1-yl)-1-piperidyl]methyl]benzohydrazide CAS Name: N'-(5-bromo-2-cyano-4-pyrimidinyl)-N'-cyclopentyl-4-[[4-(4-methyl-1-piperazinyl)-1-piperidinyl]methyl]benzohydrazide IUPAC Name: N'-(5-bromo-2-cyanopyrimidin-4-yl)-N'-cyclopentyl-4-[[4-(4-methylpiperazin-1-yl)piperidin-1-yl]methyl]benzohydrazide Traditional Name: N'-(5-bromo-2-cyano-pyrimidin-4-yl)-N'-cyclopentyl-4-[[4-(4-methylpiperazino)piperidino]methyl]benzohydrazide Formula: C28H37BrN8O MolecularWeight: 581.55038

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2)CC3=CC=C(C=C3)C(=O)NN(C4CCCC4)C5=NC(=NC=C5Br)C#N

Isomeric SMILES

CN1CCN(CC1)C2CCN(CC2)CC3=CC=C(C=C3)C(=O)NN(C4CCCC4)C5=NC(=NC=C5Br)C#N

InChI

InChI=1S/C28H37BrN8O/c1-34-14-16-36(17-15-34)23-10-12-35(13-11-23)20-21-6-8-22(9-7-21)28(38)33-37(24-4-2-3-5-24)27-25(29)19-31-26(18-30)32-27/h6-9,19,23-24H,2-5,10-17,20H2,1H3,(H,33,38)