methyl 4-(2-carbamothioyl-3-fluoranyl-phenoxy)butanoate

Systemtic Name: methyl 4-(2-carbamothioyl-3-fluoranyl-phenoxy)butanoate Openeye Name: methyl 4-(2-carbamothioyl-3-fluoro-phenoxy)butanoate CAS Name: 4-(2-carbamothioyl-3-fluorophenoxy)butanoic acid methyl ester IUPAC Name: methyl 4-(2-carbamothioyl-3-fluorophenoxy)butanoate Traditional Name: 4-(3-fluoro-2-thiocarbamoyl-phenoxy)butyric acid methyl ester Formula: C12H14FNO3S MolecularWeight: 271.307863

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCOC1=C(C(=CC=C1)F)C(=S)N

Isomeric SMILES

COC(=O)CCCOC1=C(C(=CC=C1)F)C(=S)N

InChI

InChI=1S/C12H14FNO3S/c1-16-10(15)6-3-7-17-9-5-2-4-8(13)11(9)12(14)18/h2,4-5H,3,6-7H2,1H3,(H2,14,18)