[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(4-acetamidophenyl)sulfanylethanoate

Systemtic Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(4-acetamidophenyl)sulfanylethanoate Openeye Name: [2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl] 2-(4-acetamidophenyl)sulfanylacetate CAS Name: 2-[(4-acetamidophenyl)thio]acetic acid [2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2-(4-acetamidophenyl)sulfanylacetate Traditional Name: 2-[(4-acetamidophenyl)thio]acetic acid [2-(2-furfurylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H19N3O6S MolecularWeight: 405.42496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)OCC(=O)NC(=O)NCC2=CC=CO2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)OCC(=O)NC(=O)NCC2=CC=CO2

InChI

InChI=1S/C18H19N3O6S/c1-12(22)20-13-4-6-15(7-5-13)28-11-17(24)27-10-16(23)21-18(25)19-9-14-3-2-8-26-14/h2-8H,9-11H2,1H3,(H,20,22)(H2,19,21,23,25)