methyl 5-[[1-(phenylmethyl)imidazol-2-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[1-(phenylmethyl)imidazol-2-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(1-benzylimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[1-(phenylmethyl)-2-imidazolyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(1-benzylimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(1-benzylimidazol-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NC=CN2CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NC=CN2CC3=CC=CC=C3

InChI

InChI=1S/C17H16N2O3S/c1-21-16(20)15-8-7-14(22-15)12-23-17-18-9-10-19(17)11-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3