methyl 3-(phenylmethyl)-2-(phenylmethylsulfanyl)imidazole-4-carboxylate

Systemtic Name: methyl 3-(phenylmethyl)-2-(phenylmethylsulfanyl)imidazole-4-carboxylate Openeye Name: methyl 3-benzyl-2-benzylsulfanyl-imidazole-4-carboxylate CAS Name: 3-(phenylmethyl)-2-(phenylmethylthio)-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 3-benzyl-2-benzylsulfanylimidazole-4-carboxylate Traditional Name: 3-benzyl-2-(benzylthio)imidazole-4-carboxylic acid methyl ester Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N1CC2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CN=C(N1CC2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O2S/c1-23-18(22)17-12-20-19(24-14-16-10-6-3-7-11-16)21(17)13-15-8-4-2-5-9-15/h2-12H,13-14H2,1H3