3-[(3,5-ditert-butyl-4-phenylmethoxy-phenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide

Systemtic Name: 3-[(3,5-ditert-butyl-4-phenylmethoxy-phenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide Openeye Name: 3-[(4-benzyloxy-3,5-ditert-butyl-phenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide CAS Name: 3-[(3,5-ditert-butyl-4-phenylmethoxyphenyl)methyl]-5-(1-oxopropylamino)-4-imidazolecarboxamide IUPAC Name: 3-[(3,5-ditert-butyl-4-phenylmethoxyphenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide Traditional Name: 3-(4-benzoxy-3,5-ditert-butyl-benzyl)-5-propionamido-imidazole-4-carboxamide Formula: C29H38N4O3 MolecularWeight: 490.63702

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(N(C=N1)CC2=CC(=C(C(=C2)C(C)(C)C)OCC3=CC=CC=C3)C(C)(C)C)C(=O)N

Isomeric SMILES

CCC(=O)NC1=C(N(C=N1)CC2=CC(=C(C(=C2)C(C)(C)C)OCC3=CC=CC=C3)C(C)(C)C)C(=O)N

InChI

InChI=1S/C29H38N4O3/c1-8-23(34)32-27-24(26(30)35)33(18-31-27)16-20-14-21(28(2,3)4)25(22(15-20)29(5,6)7)36-17-19-12-10-9-11-13-19/h9-15,18H,8,16-17H2,1-7H3,(H2,30,35)(H,32,34)