methyl 3-[phenyl(pyridin-2-yl)methyl]-2-sulfanylidene-1H-imidazole-4-carboxylate

Systemtic Name: methyl 3-[phenyl(pyridin-2-yl)methyl]-2-sulfanylidene-1H-imidazole-4-carboxylate Openeye Name: methyl 3-[phenyl(2-pyridyl)methyl]-2-thioxo-1H-imidazole-4-carboxylate CAS Name: 3-[phenyl(2-pyridinyl)methyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-[phenyl(pyridin-2-yl)methyl]-2-sulfanylidene-1H-imidazole-4-carboxylate Traditional Name: 3-[phenyl(2-pyridyl)methyl]-2-thioxo-4-imidazoline-4-carboxylic acid methyl ester Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC(=S)N1C(C2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

COC(=O)C1=CNC(=S)N1C(C2=CC=CC=C2)C3=CC=CC=N3

InChI

InChI=1S/C17H15N3O2S/c1-22-16(21)14-11-19-17(23)20(14)15(12-7-3-2-4-8-12)13-9-5-6-10-18-13/h2-11,15H,1H3,(H,19,23)