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

Systemtic Name: (phenylmethyl) 2-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]morpholine-4-carboxylate Openeye Name: benzyl 2-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]morpholine-4-carboxylate CAS Name: 2-[1-[[4-(1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-4-morpholinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]morpholine-4-carboxylate Traditional Name: 2-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]morpholine-4-carboxylic acid benzyl ester Formula: C25H26N6O3 MolecularWeight: 458.51234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CN(CCO1)C(=O)OCC2=CC=CC=C2)NC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

Isomeric SMILES

CC(C1CN(CCO1)C(=O)OCC2=CC=CC=C2)NC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C25H26N6O3/c1-18(22-15-30(13-14-33-22)25(32)34-16-19-7-3-2-4-8-19)28-24-26-12-11-23(29-24)31-17-27-20-9-5-6-10-21(20)31/h2-12,17-18,22H,13-16H2,1H3,(H,26,28,29)