ethyl 3-(2,6-diethylphenyl)-2-(phenylmethylsulfanyl)-2H-imidazole-1-carboxylate

Systemtic Name: ethyl 3-(2,6-diethylphenyl)-2-(phenylmethylsulfanyl)-2H-imidazole-1-carboxylate Openeye Name: ethyl 2-benzylsulfanyl-3-(2,6-diethylphenyl)-2H-imidazole-1-carboxylate CAS Name: 3-(2,6-diethylphenyl)-2-(phenylmethylthio)-2H-imidazole-1-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-3-(2,6-diethylphenyl)-2H-imidazole-1-carboxylate Traditional Name: 2-(benzylthio)-3-(2,6-diethylphenyl)-4-imidazoline-1-carboxylic acid ethyl ester Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2C=CN(C2SCC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C=CN(C2SCC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C23H28N2O2S/c1-4-19-13-10-14-20(5-2)21(19)24-15-16-25(23(26)27-6-3)22(24)28-17-18-11-8-7-9-12-18/h7-16,22H,4-6,17H2,1-3H3