[2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 3-fluoranyl-4-methyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 3-fluoranyl-4-methyl-benzoate Openeye Name: [2-oxo-2-[2-(2-thienylmethylsulfanyl)ethylamino]ethyl] 3-fluoro-4-methyl-benzoate CAS Name: 3-fluoro-4-methylbenzoic acid [2-oxo-2-[2-(thiophen-2-ylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 3-fluoro-4-methylbenzoate Traditional Name: 3-fluoro-4-methyl-benzoic acid [2-keto-2-[2-(2-thenylthio)ethylamino]ethyl] ester Formula: C17H18FNO3S2 MolecularWeight: 367.458123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCCSCC2=CC=CS2)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCCSCC2=CC=CS2)F

InChI

InChI=1S/C17H18FNO3S2/c1-12-4-5-13(9-15(12)18)17(21)22-10-16(20)19-6-8-23-11-14-3-2-7-24-14/h2-5,7,9H,6,8,10-11H2,1H3,(H,19,20)