(phenylmethyl) 4-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methyl-amino]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methyl-amino]piperidine-1-carboxylate Openeye Name: benzyl 4-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methyl-amino]piperidine-1-carboxylate CAS Name: 4-[[4-(1-benzimidazolyl)-2-pyrimidinyl]-methylamino]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methylamino]piperidine-1-carboxylate Traditional Name: 4-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]-methyl-amino]piperidine-1-carboxylic acid benzyl ester Formula: C25H26N6O2 MolecularWeight: 442.51294

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)C(=O)OCC2=CC=CC=C2)C3=NC=CC(=N3)N4C=NC5=CC=CC=C54

Isomeric SMILES

CN(C1CCN(CC1)C(=O)OCC2=CC=CC=C2)C3=NC=CC(=N3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C25H26N6O2/c1-29(20-12-15-30(16-13-20)25(32)33-17-19-7-3-2-4-8-19)24-26-14-11-23(28-24)31-18-27-21-9-5-6-10-22(21)31/h2-11,14,18,20H,12-13,15-17H2,1H3