cyanomethyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate

Systemtic Name: cyanomethyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate Openeye Name: cyanomethyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate CAS Name: 2-(methylthio)-3-phenyl-4-imidazolecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-methylsulfanyl-3-phenylimidazole-4-carboxylate Traditional Name: 2-(methylthio)-3-phenyl-imidazole-4-carboxylic acid cyanomethyl ester Formula: C13H11N3O2S MolecularWeight: 273.31034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O2S/c1-19-13-15-9-11(12(17)18-8-7-14)16(13)10-5-3-2-4-6-10/h2-6,9H,8H2,1H3