N-[2-[[6-[4-(2-cyclopentyl-2-phenyl-ethanoyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide

Systemtic Name: N-[2-[[6-[4-(2-cyclopentyl-2-phenyl-ethanoyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[6-[4-(2-cyclopentyl-2-phenyl-acetyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[4-(2-cyclopentyl-1-oxo-2-phenylethyl)-1-piperazinyl]-2-phenyl-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[6-[4-(2-cyclopentyl-2-phenylacetyl)piperazin-1-yl]-2-phenylpyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[6-[4-(2-cyclopentyl-2-phenyl-acetyl)piperazino]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide Formula: C31H38N6O2 MolecularWeight: 526.67242

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)C(C3CCCC3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)C(C3CCCC3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H38N6O2/c1-23(38)32-16-17-33-27-22-28(35-30(34-27)26-14-6-3-7-15-26)36-18-20-37(21-19-36)31(39)29(25-12-8-9-13-25)24-10-4-2-5-11-24/h2-7,10-11,14-15,22,25,29H,8-9,12-13,16-21H2,1H3,(H,32,38)(H,33,34,35)