tert-butyl 5-[[4-aminocarbonyl-2-butyl-2-methyl-5-(2-methylpentan-3-yl)-3-oxidanyl-imidazol-1-yl]methyl]-2-phenyl-benzoate

Systemtic Name: tert-butyl 5-[[4-aminocarbonyl-2-butyl-2-methyl-5-(2-methylpentan-3-yl)-3-oxidanyl-imidazol-1-yl]methyl]-2-phenyl-benzoate Openeye Name: tert-butyl 5-[[2-butyl-4-carbamoyl-5-(1-ethyl-2-methyl-propyl)-3-hydroxy-2-methyl-imidazol-1-yl]methyl]-2-phenyl-benzoate CAS Name: 5-[[2-butyl-4-carbamoyl-3-hydroxy-2-methyl-5-(2-methylpentan-3-yl)-1-imidazolyl]methyl]-2-phenylbenzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-[[2-butyl-4-carbamoyl-3-hydroxy-2-methyl-5-(2-methylpentan-3-yl)imidazol-1-yl]methyl]-2-phenylbenzoate Traditional Name: 5-[[2-butyl-4-carbamoyl-5-(1-ethyl-2-methyl-propyl)-3-hydroxy-2-methyl-4-imidazolin-1-yl]methyl]-2-phenyl-benzoic acid tert-butyl ester Formula: C33H47N3O4 MolecularWeight: 549.74398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(N(C(=C(N1O)C(=O)N)C(CC)C(C)C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCCCC1(N(C(=C(N1O)C(=O)N)C(CC)C(C)C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C33H47N3O4/c1-9-11-19-33(8)35(28(25(10-2)22(3)4)29(30(34)37)36(33)39)21-23-17-18-26(24-15-13-12-14-16-24)27(20-23)31(38)40-32(5,6)7/h12-18,20,22,25,39H,9-11,19,21H2,1-8H3,(H2,34,37)