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

Systemtic Name: N-[2-[[6-[4-(2-phenoxypropanoyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[6-[4-(2-phenoxypropanoyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[4-(1-oxo-2-phenoxypropyl)-1-piperazinyl]-2-phenyl-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[6-[4-(2-phenoxypropanoyl)piperazin-1-yl]-2-phenylpyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[6-[4-(2-phenoxypropanoyl)piperazino]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide Formula: C27H32N6O3 MolecularWeight: 488.58138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC(=NC(=N2)C3=CC=CC=C3)NCCNC(=O)C)OC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC(=NC(=N2)C3=CC=CC=C3)NCCNC(=O)C)OC4=CC=CC=C4

InChI

InChI=1S/C27H32N6O3/c1-20(36-23-11-7-4-8-12-23)27(35)33-17-15-32(16-18-33)25-19-24(29-14-13-28-21(2)34)30-26(31-25)22-9-5-3-6-10-22/h3-12,19-20H,13-18H2,1-2H3,(H,28,34)(H,29,30,31)