[2-[(2-methyl-1-thiophen-2-yl-propyl)amino]-2-oxidanylidene-ethyl] 5-[(4-fluoranylphenoxy)methyl]furan-2-carboxylate

Systemtic Name: [2-[(2-methyl-1-thiophen-2-yl-propyl)amino]-2-oxidanylidene-ethyl] 5-[(4-fluoranylphenoxy)methyl]furan-2-carboxylate Openeye Name: [2-[[2-methyl-1-(2-thienyl)propyl]amino]-2-oxo-ethyl] 5-[(4-fluorophenoxy)methyl]furan-2-carboxylate CAS Name: 5-[(4-fluorophenoxy)methyl]-2-furancarboxylic acid [2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl] 5-[(4-fluorophenoxy)methyl]furan-2-carboxylate Traditional Name: 5-[(4-fluorophenoxy)methyl]furan-2-carboxylic acid [2-keto-2-[[2-methyl-1-(2-thienyl)propyl]amino]ethyl] ester Formula: C22H22FNO5S MolecularWeight: 431.477183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)COC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C(C1=CC=CS1)NC(=O)COC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FNO5S/c1-14(2)21(19-4-3-11-30-19)24-20(25)13-28-22(26)18-10-9-17(29-18)12-27-16-7-5-15(23)6-8-16/h3-11,14,21H,12-13H2,1-2H3,(H,24,25)