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

Systemtic Name: ethyl 2-butyl-5-ethylsulfanyl-3-[[4-(2-methoxycarbonylphenyl)phenyl]methyl]imidazole-4-carboxylate Openeye Name: ethyl 2-butyl-5-ethylsulfanyl-3-[[4-(2-methoxycarbonylphenyl)phenyl]methyl]imidazole-4-carboxylate CAS Name: 2-butyl-5-(ethylthio)-3-[[4-(2-methoxycarbonylphenyl)phenyl]methyl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-5-ethylsulfanyl-3-[[4-(2-methoxycarbonylphenyl)phenyl]methyl]imidazole-4-carboxylate Traditional Name: 2-butyl-3-[4-(2-carbomethoxyphenyl)benzyl]-5-(ethylthio)imidazole-4-carboxylic acid ethyl ester Formula: C27H32N2O4S MolecularWeight: 480.61898

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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(=O)OCC)SCC

Isomeric SMILES

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

InChI

InChI=1S/C27H32N2O4S/c1-5-8-13-23-28-25(34-7-3)24(27(31)33-6-2)29(23)18-19-14-16-20(17-15-19)21-11-9-10-12-22(21)26(30)32-4/h9-12,14-17H,5-8,13,18H2,1-4H3