ethyl 3-[2-(furan-2-ylmethylsulfanyl)ethylcarbamoylamino]benzoate

Systemtic Name: ethyl 3-[2-(furan-2-ylmethylsulfanyl)ethylcarbamoylamino]benzoate Openeye Name: ethyl 3-[2-(2-furylmethylsulfanyl)ethylcarbamoylamino]benzoate CAS Name: 3-[[[2-(2-furanylmethylthio)ethylamino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(furan-2-ylmethylsulfanyl)ethylcarbamoylamino]benzoate Traditional Name: 3-[2-(2-furfurylthio)ethylcarbamoylamino]benzoic acid ethyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCCSCC2=CC=CO2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCCSCC2=CC=CO2

InChI

InChI=1S/C17H20N2O4S/c1-2-22-16(20)13-5-3-6-14(11-13)19-17(21)18-8-10-24-12-15-7-4-9-23-15/h3-7,9,11H,2,8,10,12H2,1H3,(H2,18,19,21)