methyl 4-[[4-[[(2-tert-butyl-1H-benzimidazol-4-yl)carbonylamino]methyl]piperidin-1-yl]methyl]piperidine-1-carboxylate

Systemtic Name: methyl 4-[[4-[[(2-tert-butyl-1H-benzimidazol-4-yl)carbonylamino]methyl]piperidin-1-yl]methyl]piperidine-1-carboxylate Openeye Name: methyl 4-[[4-[[(2-tert-butyl-1H-benzimidazole-4-carbonyl)amino]methyl]-1-piperidyl]methyl]piperidine-1-carboxylate CAS Name: 4-[[4-[[[(2-tert-butyl-1H-benzimidazol-4-yl)-oxomethyl]amino]methyl]-1-piperidinyl]methyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[[4-[[(2-tert-butyl-1H-benzimidazole-4-carbonyl)amino]methyl]piperidin-1-yl]methyl]piperidine-1-carboxylate Traditional Name: 4-[[4-[[(2-tert-butyl-1H-benzimidazole-4-carbonyl)amino]methyl]piperidino]methyl]piperidine-1-carboxylic acid methyl ester Formula: C26H39N5O3 MolecularWeight: 469.61956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C=CC=C2N1)C(=O)NCC3CCN(CC3)CC4CCN(CC4)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=NC2=C(C=CC=C2N1)C(=O)NCC3CCN(CC3)CC4CCN(CC4)C(=O)OC

InChI

InChI=1S/C26H39N5O3/c1-26(2,3)24-28-21-7-5-6-20(22(21)29-24)23(32)27-16-18-8-12-30(13-9-18)17-19-10-14-31(15-11-19)25(33)34-4/h5-7,18-19H,8-17H2,1-4H3,(H,27,32)(H,28,29)