2-(2-fluorophenyl)sulfanylethyl 3-(furan-2-ylcarbonylamino)-4-methyl-benzoate

Systemtic Name: 2-(2-fluorophenyl)sulfanylethyl 3-(furan-2-ylcarbonylamino)-4-methyl-benzoate Openeye Name: 2-(2-fluorophenyl)sulfanylethyl 3-(furan-2-carbonylamino)-4-methyl-benzoate CAS Name: 3-[[2-furanyl(oxo)methyl]amino]-4-methylbenzoic acid 2-[(2-fluorophenyl)thio]ethyl ester IUPAC Name: 2-(2-fluorophenyl)sulfanylethyl 3-(furan-2-carbonylamino)-4-methylbenzoate Traditional Name: 3-(2-furoylamino)-4-methyl-benzoic acid 2-[(2-fluorophenyl)thio]ethyl ester Formula: C21H18FNO4S MolecularWeight: 399.435323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCCSC2=CC=CC=C2F)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCCSC2=CC=CC=C2F)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H18FNO4S/c1-14-8-9-15(13-17(14)23-20(24)18-6-4-10-26-18)21(25)27-11-12-28-19-7-3-2-5-16(19)22/h2-10,13H,11-12H2,1H3,(H,23,24)