methyl 3-[2-[1-(furan-2-ylmethyl)-5-(4-methoxyphenyl)imidazol-2-yl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[1-(furan-2-ylmethyl)-5-(4-methoxyphenyl)imidazol-2-yl]sulfanylethanoylamino]benzoate Openeye Name: methyl 3-[[2-[1-(2-furylmethyl)-5-(4-methoxyphenyl)imidazol-2-yl]sulfanylacetyl]amino]benzoate CAS Name: 3-[[2-[[1-(2-furanylmethyl)-5-(4-methoxyphenyl)-2-imidazolyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[1-(furan-2-ylmethyl)-5-(4-methoxyphenyl)imidazol-2-yl]sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[[1-(2-furfuryl)-5-(4-methoxyphenyl)imidazol-2-yl]thio]acetyl]amino]benzoic acid methyl ester Formula: C25H23N3O5S MolecularWeight: 477.53222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N2CC3=CC=CO3)SCC(=O)NC4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N2CC3=CC=CO3)SCC(=O)NC4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C25H23N3O5S/c1-31-20-10-8-17(9-11-20)22-14-26-25(28(22)15-21-7-4-12-33-21)34-16-23(29)27-19-6-3-5-18(13-19)24(30)32-2/h3-14H,15-16H2,1-2H3,(H,27,29)