(phenylmethyl) (2S)-2-(6-pyridin-4-yl-1H-benzimidazol-2-yl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-(6-pyridin-4-yl-1H-benzimidazol-2-yl)pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[6-(4-pyridyl)-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-(6-pyridin-4-yl-1H-benzimidazol-2-yl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(6-pyridin-4-yl-1H-benzimidazol-2-yl)pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[6-(4-pyridyl)-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C24H22N4O2 MolecularWeight: 398.45708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C3=NC4=C(N3)C=C(C=C4)C5=CC=NC=C5

Isomeric SMILES

C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C3=NC4=C(N3)C=C(C=C4)C5=CC=NC=C5

InChI

InChI=1S/C24H22N4O2/c29-24(30-16-17-5-2-1-3-6-17)28-14-4-7-22(28)23-26-20-9-8-19(15-21(20)27-23)18-10-12-25-13-11-18/h1-3,5-6,8-13,15,22H,4,7,14,16H2,(H,26,27)/t22-/m0/s1