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

Systemtic Name: ethyl 3-[2-(furan-2-ylmethylsulfanyl)ethylcarbamothioylamino]benzoate Openeye Name: ethyl 3-[2-(2-furylmethylsulfanyl)ethylcarbamothioylamino]benzoate CAS Name: 3-[[[2-(2-furanylmethylthio)ethylamino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(furan-2-ylmethylsulfanyl)ethylcarbamothioylamino]benzoate Traditional Name: 3-[2-(2-furfurylthio)ethylthiocarbamoylamino]benzoic acid ethyl ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O3S2/c1-2-21-16(20)13-5-3-6-14(11-13)19-17(23)18-8-10-24-12-15-7-4-9-22-15/h3-7,9,11H,2,8,10,12H2,1H3,(H2,18,19,23)