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

Systemtic Name: N'-(5-bromanyl-2-cyano-pyrimidin-4-yl)-N'-cyclohexyl-4-[[4-(4-methylpiperazin-1-yl)piperidin-1-yl]methyl]benzohydrazide Openeye Name: N'-(5-bromo-2-cyano-pyrimidin-4-yl)-N'-cyclohexyl-4-[[4-(4-methylpiperazin-1-yl)-1-piperidyl]methyl]benzohydrazide CAS Name: N'-(5-bromo-2-cyano-4-pyrimidinyl)-N'-cyclohexyl-4-[[4-(4-methyl-1-piperazinyl)-1-piperidinyl]methyl]benzohydrazide IUPAC Name: N'-(5-bromo-2-cyanopyrimidin-4-yl)-N'-cyclohexyl-4-[[4-(4-methylpiperazin-1-yl)piperidin-1-yl]methyl]benzohydrazide Traditional Name: N'-(5-bromo-2-cyano-pyrimidin-4-yl)-N'-cyclohexyl-4-[[4-(4-methylpiperazino)piperidino]methyl]benzohydrazide Formula: C29H39BrN8O MolecularWeight: 595.57696

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2)CC3=CC=C(C=C3)C(=O)NN(C4CCCCC4)C5=NC(=NC=C5Br)C#N

Isomeric SMILES

CN1CCN(CC1)C2CCN(CC2)CC3=CC=C(C=C3)C(=O)NN(C4CCCCC4)C5=NC(=NC=C5Br)C#N

InChI

InChI=1S/C29H39BrN8O/c1-35-15-17-37(18-16-35)24-11-13-36(14-12-24)21-22-7-9-23(10-8-22)29(39)34-38(25-5-3-2-4-6-25)28-26(30)20-32-27(19-31)33-28/h7-10,20,24-25H,2-6,11-18,21H2,1H3,(H,34,39)