methyl 5-[[3-[(2-fluorophenyl)amino]-3-oxidanylidene-propyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[3-[(2-fluorophenyl)amino]-3-oxidanylidene-propyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[3-(2-fluoroanilino)-3-oxo-propyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[3-(2-fluoroanilino)-3-oxopropyl]thio]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-(2-fluoroanilino)-3-oxopropyl]sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[[3-(2-fluoroanilino)-3-keto-propyl]thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C17H18FNO4S MolecularWeight: 351.392523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSCCC(=O)NC2=CC=CC=C2F)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSCCC(=O)NC2=CC=CC=C2F)C(=O)OC

InChI

InChI=1S/C17H18FNO4S/c1-11-13(17(21)22-2)9-12(23-11)10-24-8-7-16(20)19-15-6-4-3-5-14(15)18/h3-6,9H,7-8,10H2,1-2H3,(H,19,20)