N-[2-[[6-[4-(3-methyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide

Systemtic Name: N-[2-[[6-[4-(3-methyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[6-[4-(2-hydroxy-3-methyl-benzoyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[4-[(2-hydroxy-3-methylphenyl)-oxomethyl]-1-piperazinyl]-2-phenyl-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[6-[4-(2-hydroxy-3-methylbenzoyl)piperazin-1-yl]-2-phenylpyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[6-[4-(2-hydroxy-3-methyl-benzoyl)piperazino]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide Formula: C26H30N6O3 MolecularWeight: 474.5548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)N2CCN(CC2)C3=CC(=NC(=N3)C4=CC=CC=C4)NCCNC(=O)C

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)N2CCN(CC2)C3=CC(=NC(=N3)C4=CC=CC=C4)NCCNC(=O)C

InChI

InChI=1S/C26H30N6O3/c1-18-7-6-10-21(24(18)34)26(35)32-15-13-31(14-16-32)23-17-22(28-12-11-27-19(2)33)29-25(30-23)20-8-4-3-5-9-20/h3-10,17,34H,11-16H2,1-2H3,(H,27,33)(H,28,29,30)