tert-butyl 5-[(1-phenylmethoxycarbonylpyrrolidin-3-yl)carbamoyl]benzimidazole-1-carboxylate

Systemtic Name: tert-butyl 5-[(1-phenylmethoxycarbonylpyrrolidin-3-yl)carbamoyl]benzimidazole-1-carboxylate Openeye Name: tert-butyl 5-[(1-benzyloxycarbonylpyrrolidin-3-yl)carbamoyl]benzimidazole-1-carboxylate CAS Name: 5-[oxo-[(1-phenylmethoxycarbonyl-3-pyrrolidinyl)amino]methyl]-1-benzimidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(1-phenylmethoxycarbonylpyrrolidin-3-yl)carbamoyl]benzimidazole-1-carboxylate Traditional Name: 5-[(1-carbobenzoxypyrrolidin-3-yl)carbamoyl]benzimidazole-1-carboxylic acid tert-butyl ester Formula: C25H28N4O5 MolecularWeight: 464.51362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=NC2=C1C=CC(=C2)C(=O)NC3CCN(C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C=NC2=C1C=CC(=C2)C(=O)NC3CCN(C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O5/c1-25(2,3)34-24(32)29-16-26-20-13-18(9-10-21(20)29)22(30)27-19-11-12-28(14-19)23(31)33-15-17-7-5-4-6-8-17/h4-10,13,16,19H,11-12,14-15H2,1-3H3,(H,27,30)