N-[2-[[6-[4-(2-tert-butyl-5-methyl-pyrazol-3-yl)carbonylpiperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide

Systemtic Name: N-[2-[[6-[4-(2-tert-butyl-5-methyl-pyrazol-3-yl)carbonylpiperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[6-[4-(2-tert-butyl-5-methyl-pyrazole-3-carbonyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[4-[(2-tert-butyl-5-methyl-3-pyrazolyl)-oxomethyl]-1-piperazinyl]-2-phenyl-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[6-[4-(2-tert-butyl-5-methylpyrazole-3-carbonyl)piperazin-1-yl]-2-phenylpyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[6-[4-(2-tert-butyl-5-methyl-pyrazole-3-carbonyl)piperazino]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide Formula: C27H36N8O2 MolecularWeight: 504.62714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H36N8O2/c1-19-17-22(35(32-19)27(3,4)5)26(37)34-15-13-33(14-16-34)24-18-23(29-12-11-28-20(2)36)30-25(31-24)21-9-7-6-8-10-21/h6-10,17-18H,11-16H2,1-5H3,(H,28,36)(H,29,30,31)