methyl 5-[[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]thio]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]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)CSCC(=O)NCC2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSCC(=O)NCC2=CC=C(C=C2)F)C(=O)OC

InChI

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