(phenylmethyl) (2S)-2-[6-[4-(cyclopropylcarbonylamino)phenyl]-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[6-[4-(cyclopropylcarbonylamino)phenyl]-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[6-[4-(cyclopropanecarbonylamino)phenyl]-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[6-[4-[[cyclopropyl(oxo)methyl]amino]phenyl]-1H-benzimidazol-2-yl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[6-[4-(cyclopropanecarbonylamino)phenyl]-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[6-[4-(cyclopropanecarbonylamino)phenyl]-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C29H28N4O3 MolecularWeight: 480.55762

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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=C(C=C5)NC(=O)C6CC6

Isomeric SMILES

C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C3=NC4=C(N3)C=C(C=C4)C5=CC=C(C=C5)NC(=O)C6CC6

InChI

InChI=1S/C29H28N4O3/c34-28(21-8-9-21)30-23-13-10-20(11-14-23)22-12-15-24-25(17-22)32-27(31-24)26-7-4-16-33(26)29(35)36-18-19-5-2-1-3-6-19/h1-3,5-6,10-15,17,21,26H,4,7-9,16,18H2,(H,30,34)(H,31,32)/t26-/m0/s1