(4-cyanophenyl)methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate Openeye Name: (4-cyanophenyl)methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate CAS Name: 2-(methylthio)-3-phenyl-4-imidazolecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-methylsulfanyl-3-phenylimidazole-4-carboxylate Traditional Name: 2-(methylthio)-3-phenyl-imidazole-4-carboxylic acid (4-cyanobenzyl) ester Formula: C19H15N3O2S MolecularWeight: 349.4063

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H15N3O2S/c1-25-19-21-12-17(22(19)16-5-3-2-4-6-16)18(23)24-13-15-9-7-14(11-20)8-10-15/h2-10,12H,13H2,1H3