[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C17H17NO5S MolecularWeight: 347.38558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=CC=CC=C1C(=O)OCC(=O)NCC2=CC=CO2

Isomeric SMILES

CC(=O)CSC1=CC=CC=C1C(=O)OCC(=O)NCC2=CC=CO2

InChI

InChI=1S/C17H17NO5S/c1-12(19)11-24-15-7-3-2-6-14(15)17(21)23-10-16(20)18-9-13-5-4-8-22-13/h2-8H,9-11H2,1H3,(H,18,20)