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

Systemtic Name: N-[2-[[6-[4-(3-methylphenyl)carbonylpiperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[6-[4-(3-methylbenzoyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[4-[(3-methylphenyl)-oxomethyl]-1-piperazinyl]-2-phenyl-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[6-[4-(3-methylbenzoyl)piperazin-1-yl]-2-phenylpyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[6-(4-m-toluoylpiperazino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide Formula: C26H30N6O2 MolecularWeight: 458.5554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC(=NC(=N3)C4=CC=CC=C4)NCCNC(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC(=NC(=N3)C4=CC=CC=C4)NCCNC(=O)C

InChI

InChI=1S/C26H30N6O2/c1-19-7-6-10-22(17-19)26(34)32-15-13-31(14-16-32)24-18-23(28-12-11-27-20(2)33)29-25(30-24)21-8-4-3-5-9-21/h3-10,17-18H,11-16H2,1-2H3,(H,27,33)(H,28,29,30)