[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-methylsulfanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-methylsulfanylbenzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C14H18N2O4S MolecularWeight: 310.36872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O4S/c1-9(2)15-14(19)16-12(17)8-20-13(18)10-4-6-11(21-3)7-5-10/h4-7,9H,8H2,1-3H3,(H2,15,16,17,19)