[(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: [(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: [(1R)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl] 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid [(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid [(1R)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl] ester Formula: C15H18N2O5S MolecularWeight: 338.37882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)OC(=O)C1=CC=CC=C1SCC(=O)C

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC)OC(=O)C1=CC=CC=C1SCC(=O)C

InChI

InChI=1S/C15H18N2O5S/c1-9(18)8-23-12-7-5-4-6-11(12)14(20)22-10(2)13(19)17-15(21)16-3/h4-7,10H,8H2,1-3H3,(H2,16,17,19,21)/t10-/m1/s1