4-[[3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-[[3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxamide Openeye Name: 4-[[3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxamide CAS Name: 4-[[3-methyl-5-[[4-(2-phenyl-3-pyrazolyl)-2-pyrimidinyl]amino]phenyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-[[3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methyl]piperazine-1-carboxamide Traditional Name: 4-[3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]benzyl]piperazine-1-carboxamide Formula: C26H28N8O MolecularWeight: 468.55352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC=NN3C4=CC=CC=C4)CN5CCN(CC5)C(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC=NN3C4=CC=CC=C4)CN5CCN(CC5)C(=O)N

InChI

InChI=1S/C26H28N8O/c1-19-15-20(18-32-11-13-33(14-12-32)25(27)35)17-21(16-19)30-26-28-9-7-23(31-26)24-8-10-29-34(24)22-5-3-2-4-6-22/h2-10,15-17H,11-14,18H2,1H3,(H2,27,35)(H,28,30,31)