[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O5S/c1-10(2)17-16(22)18-14(20)8-23-15(21)12-6-4-5-7-13(12)24-9-11(3)19/h4-7,10H,8-9H2,1-3H3,(H2,17,18,20,22)