(phenylmethyl) 2-[methyl-(3-oxidanylidene-3-thiomorpholin-4-yl-propyl)carbamoyl]oxy-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-[methyl-(3-oxidanylidene-3-thiomorpholin-4-yl-propyl)carbamoyl]oxy-3-phenyl-propanoate Openeye Name: benzyl 2-[methyl-(3-oxo-3-thiomorpholino-propyl)carbamoyl]oxy-3-phenyl-propanoate CAS Name: 2-[[methyl-(3-oxo-3-thiomorpholin-4-ylpropyl)amino]-oxomethoxy]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[methyl-(3-oxo-3-thiomorpholin-4-ylpropyl)carbamoyl]oxy-3-phenylpropanoate Traditional Name: 2-[(3-keto-3-thiomorpholino-propyl)-methyl-carbamoyl]oxy-3-phenyl-propionic acid benzyl ester Formula: C25H30N2O5S MolecularWeight: 470.5811

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)N1CCSCC1)C(=O)OC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(CCC(=O)N1CCSCC1)C(=O)OC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H30N2O5S/c1-26(13-12-23(28)27-14-16-33-17-15-27)25(30)32-22(18-20-8-4-2-5-9-20)24(29)31-19-21-10-6-3-7-11-21/h2-11,22H,12-19H2,1H3