O3-tert-butyl O5-methyl 5-[(4-methoxyphenyl)methylsulfanyl]-4,6-dihydrocyclopenta[d]imidazole-3,5-dicarboxylate

Systemtic Name: O3-tert-butyl O5-methyl 5-[(4-methoxyphenyl)methylsulfanyl]-4,6-dihydrocyclopenta[d]imidazole-3,5-dicarboxylate Openeye Name: O3-tert-butyl O5-methyl 5-[(4-methoxyphenyl)methylsulfanyl]-4,6-dihydrocyclopenta[d]imidazole-3,5-dicarboxylate CAS Name: 5-[(4-methoxyphenyl)methylthio]-4,6-dihydrocyclopenta[d]imidazole-3,5-dicarboxylic acid O3-tert-butyl ester O5-methyl ester IUPAC Name: 3-O-tert-butyl 5-O-methyl 5-[(4-methoxyphenyl)methylsulfanyl]-4,6-dihydrocyclopenta[d]imidazole-3,5-dicarboxylate Traditional Name: 5-(p-anisylthio)-4,6-dihydrocyclopent[d]imidazole-3,5-dicarboxylic acid O3-tert-butyl ester O5-methyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=NC2=C1CC(C2)(C(=O)OC)SCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C=NC2=C1CC(C2)(C(=O)OC)SCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O5S/c1-20(2,3)28-19(25)23-13-22-16-10-21(11-17(16)23,18(24)27-5)29-12-14-6-8-15(26-4)9-7-14/h6-9,13H,10-12H2,1-5H3