(2-phenyl-1,3-oxazol-4-yl)methyl 2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (2-phenyl-1,3-oxazol-4-yl)methyl 2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (2-phenyloxazol-4-yl)methyl 2-[2-(2-methoxyethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(2-methoxyethylamino)-2-oxoethyl]thio]benzoic acid (2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-oxazol-4-yl)methyl 2-[2-(2-methoxyethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(2-methoxyethylamino)ethyl]thio]benzoic acid (2-phenyloxazol-4-yl)methyl ester Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CSC1=CC=CC=C1C(=O)OCC2=COC(=N2)C3=CC=CC=C3

Isomeric SMILES

COCCNC(=O)CSC1=CC=CC=C1C(=O)OCC2=COC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5S/c1-27-12-11-23-20(25)15-30-19-10-6-5-9-18(19)22(26)29-14-17-13-28-21(24-17)16-7-3-2-4-8-16/h2-10,13H,11-12,14-15H2,1H3,(H,23,25)