(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 4-(tert-butoxycarbonylamino)benzoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Traditional Name: 4-(tert-butoxycarbonylamino)benzoic acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)OCC2=COC(=N2)C3=CC=CS3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)OCC2=COC(=N2)C3=CC=CS3

InChI

InChI=1S/C20H20N2O5S/c1-20(2,3)27-19(24)22-14-8-6-13(7-9-14)18(23)26-12-15-11-25-17(21-15)16-5-4-10-28-16/h4-11H,12H2,1-3H3,(H,22,24)