(phenylmethyl) 3-[[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]methyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]methyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 3-[[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]methyl]pyrrolidine-1-carboxylate CAS Name: 3-[[[4-(1-benzimidazolyl)-2-pyrimidinyl]amino]methyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]methyl]pyrrolidine-1-carboxylate Traditional Name: 3-[[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]methyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C24H24N6O2 MolecularWeight: 428.48636

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1CNC2=NC=CC(=N2)N3C=NC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CC1CNC2=NC=CC(=N2)N3C=NC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C24H24N6O2/c31-24(32-16-18-6-2-1-3-7-18)29-13-11-19(15-29)14-26-23-25-12-10-22(28-23)30-17-27-20-8-4-5-9-21(20)30/h1-10,12,17,19H,11,13-16H2,(H,25,26,28)