N-[2-[[2-phenyl-6-(4-pyridin-4-ylcarbonylpiperazin-1-yl)pyrimidin-4-yl]amino]ethyl]ethanamide

Systemtic Name: N-[2-[[2-phenyl-6-(4-pyridin-4-ylcarbonylpiperazin-1-yl)pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[2-phenyl-6-[4-(pyridine-4-carbonyl)piperazin-1-yl]pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]-2-phenyl-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[2-phenyl-6-[4-(pyridine-4-carbonyl)piperazin-1-yl]pyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[6-(4-isonicotinoylpiperazino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide Formula: C24H27N7O2 MolecularWeight: 445.51688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)C3=CC=NC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)C3=CC=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N7O2/c1-18(32)26-11-12-27-21-17-22(29-23(28-21)19-5-3-2-4-6-19)30-13-15-31(16-14-30)24(33)20-7-9-25-10-8-20/h2-10,17H,11-16H2,1H3,(H,26,32)(H,27,28,29)