(phenylmethyl) (2S)-2-[[4-[(4-methyl-1H-benzimidazol-2-yl)methyl]phenyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[[4-[(4-methyl-1H-benzimidazol-2-yl)methyl]phenyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[[4-[(4-methyl-1H-benzimidazol-2-yl)methyl]phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[4-[(4-methyl-1H-benzimidazol-2-yl)methyl]anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[4-[(4-methyl-1H-benzimidazol-2-yl)methyl]phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[4-[(4-methyl-1H-benzimidazol-2-yl)methyl]phenyl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC(=N2)CC3=CC=C(C=C3)NC(=O)C4CCCN4C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=CC=C1)NC(=N2)CC3=CC=C(C=C3)NC(=O)[C@@H]4CCCN4C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3/c1-19-7-5-10-23-26(19)31-25(30-23)17-20-12-14-22(15-13-20)29-27(33)24-11-6-16-32(24)28(34)35-18-21-8-3-2-4-9-21/h2-5,7-10,12-15,24H,6,11,16-18H2,1H3,(H,29,33)(H,30,31)/t24-/m0/s1