N'-(5-bromanyl-2-cyano-pyrimidin-4-yl)-N'-(cyclopentylmethyl)-4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzohydrazide

Systemtic Name: N'-(5-bromanyl-2-cyano-pyrimidin-4-yl)-N'-(cyclopentylmethyl)-4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzohydrazide Openeye Name: N'-(5-bromo-2-cyano-pyrimidin-4-yl)-N'-(cyclopentylmethyl)-4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzohydrazide CAS Name: N'-(5-bromo-2-cyano-4-pyrimidinyl)-N'-(cyclopentylmethyl)-4-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]benzohydrazide IUPAC Name: N'-(5-bromo-2-cyanopyrimidin-4-yl)-N'-(cyclopentylmethyl)-4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzohydrazide Traditional Name: N'-(5-bromo-2-cyano-pyrimidin-4-yl)-N'-(cyclopentylmethyl)-4-[[4-(2-hydroxyethyl)piperazino]methyl]benzohydrazide Formula: C25H32BrN7O2 MolecularWeight: 542.47128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CN(C2=NC(=NC=C2Br)C#N)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)CCO

Isomeric SMILES

C1CCC(C1)CN(C2=NC(=NC=C2Br)C#N)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)CCO

InChI

InChI=1S/C25H32BrN7O2/c26-22-16-28-23(15-27)29-24(22)33(18-19-3-1-2-4-19)30-25(35)21-7-5-20(6-8-21)17-32-11-9-31(10-12-32)13-14-34/h5-8,16,19,34H,1-4,9-14,17-18H2,(H,30,35)