methyl 3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanylmethyl]benzoate CAS Name: 3-[[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanylmethyl]benzoate Traditional Name: 3-[[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]thio]methyl]benzoic acid methyl ester Formula: C18H18N2O5S2 MolecularWeight: 406.47592

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C18H18N2O5S2/c1-20(2)27(22,23)14-7-8-16-15(10-14)19-18(25-16)26-11-12-5-4-6-13(9-12)17(21)24-3/h4-10H,11H2,1-3H3