N-[2-[[[(2S)-1-cyclohexylpropan-2-yl]amino]methyl]phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-[2-[[[(2S)-1-cyclohexylpropan-2-yl]amino]methyl]phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-[2-[[[(1S)-2-cyclohexyl-1-methyl-ethyl]amino]methyl]phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-[2-[[[(2S)-1-cyclohexylpropan-2-yl]amino]methyl]phenyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-[2-[[[(2S)-1-cyclohexylpropan-2-yl]amino]methyl]phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-[2-[[[(1S)-2-cyclohexyl-1-methyl-ethyl]amino]methyl]phenyl]-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C26H38N6O MolecularWeight: 450.61952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1CCCCC1)NCC2=CC=CC=C2NC(=O)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C[C@@H](CC1CCCCC1)NCC2=CC=CC=C2NC(=O)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C26H38N6O/c1-21(18-22-8-3-2-4-9-22)29-19-23-10-5-6-11-24(23)30-25(33)20-31-14-16-32(17-15-31)26-27-12-7-13-28-26/h5-7,10-13,21-22,29H,2-4,8-9,14-20H2,1H3,(H,30,33)/t21-/m0/s1