ethyl 2-butyl-5-ethylsulfanyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]imidazole-4-carboxylate

Systemtic Name: ethyl 2-butyl-5-ethylsulfanyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]imidazole-4-carboxylate Openeye Name: ethyl 3-[[4-(2-tert-butoxycarbonylphenyl)phenyl]methyl]-2-butyl-5-ethylsulfanyl-imidazole-4-carboxylate CAS Name: 2-butyl-5-(ethylthio)-3-[[4-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]phenyl]methyl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-5-ethylsulfanyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]imidazole-4-carboxylate Traditional Name: 3-[4-(2-tert-butoxycarbonylphenyl)benzyl]-2-butyl-5-(ethylthio)imidazole-4-carboxylic acid ethyl ester Formula: C30H38N2O4S MolecularWeight: 522.69872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C(=O)OCC)SCC

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C(=O)OCC)SCC

InChI

InChI=1S/C30H38N2O4S/c1-7-10-15-25-31-27(37-9-3)26(29(34)35-8-2)32(25)20-21-16-18-22(19-17-21)23-13-11-12-14-24(23)28(33)36-30(4,5)6/h11-14,16-19H,7-10,15,20H2,1-6H3