(phenylmethyl) 3-[1-[(2-methoxy-2-oxidanylidene-ethyl)carbamothioyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: (phenylmethyl) 3-[1-[(2-methoxy-2-oxidanylidene-ethyl)carbamothioyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: benzyl 3-[1-[(2-methoxy-2-oxo-ethyl)carbamothioyl]-4-piperidyl]-2-oxo-oxazolidine-4-carboxylate CAS Name: 3-[1-[[(2-methoxy-2-oxoethyl)amino]-sulfanylidenemethyl]-4-piperidinyl]-2-oxo-4-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[1-[(2-methoxy-2-oxoethyl)carbamothioyl]piperidin-4-yl]-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 2-keto-3-[1-[(2-keto-2-methoxy-ethyl)thiocarbamoyl]-4-piperidyl]oxazolidine-4-carboxylic acid benzyl ester Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=S)N1CCC(CC1)N2C(COC2=O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CNC(=S)N1CCC(CC1)N2C(COC2=O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O6S/c1-27-17(24)11-21-19(30)22-9-7-15(8-10-22)23-16(13-29-20(23)26)18(25)28-12-14-5-3-2-4-6-14/h2-6,15-16H,7-13H2,1H3,(H,21,30)