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

Systemtic Name: (phenylmethyl) 2-[[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]methyl]morpholine-4-carboxylate Openeye Name: benzyl 2-[[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]methyl]morpholine-4-carboxylate CAS Name: 2-[[[4-(1-benzimidazolyl)-2-pyrimidinyl]amino]methyl]-4-morpholinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]methyl]morpholine-4-carboxylate Traditional Name: 2-[[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]methyl]morpholine-4-carboxylic acid benzyl ester Formula: C24H24N6O3 MolecularWeight: 444.48576

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=O)OCC2=CC=CC=C2)CNC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1COC(CN1C(=O)OCC2=CC=CC=C2)CNC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C24H24N6O3/c31-24(33-16-18-6-2-1-3-7-18)29-12-13-32-19(15-29)14-26-23-25-11-10-22(28-23)30-17-27-20-8-4-5-9-21(20)30/h1-11,17,19H,12-16H2,(H,25,26,28)