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

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

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)N1CCNCC1C(C2=CC=CC=C2)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5

Isomeric SMILES

CNC(=O)N1CCNCC1C(C2=CC=CC=C2)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5

InChI

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