methyl 2-[2-chloranyl-4-fluoranyl-5-(formamidocarbamoylsulfanylamino)phenyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-chloranyl-4-fluoranyl-5-(formamidocarbamoylsulfanylamino)phenyl]sulfanylethanoate Openeye Name: methyl 2-[2-chloro-4-fluoro-5-(formamidocarbamoylsulfanylamino)phenyl]sulfanylacetate CAS Name: 2-[[2-chloro-4-fluoro-5-[[[(formylhydrazo)-oxomethyl]thio]amino]phenyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-chloro-4-fluoro-5-(formamidocarbamoylsulfanylamino)phenyl]sulfanylacetate Traditional Name: 2-[[2-chloro-4-fluoro-5-[(formamidocarbamoylthio)amino]phenyl]thio]acetic acid methyl ester Formula: C11H11ClFN3O4S2 MolecularWeight: 367.804143

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C=C(C(=C1)NSC(=O)NNC=O)F)Cl

Isomeric SMILES

COC(=O)CSC1=C(C=C(C(=C1)NSC(=O)NNC=O)F)Cl

InChI

InChI=1S/C11H11ClFN3O4S2/c1-20-10(18)4-21-9-3-8(7(13)2-6(9)12)16-22-11(19)15-14-5-17/h2-3,5,16H,4H2,1H3,(H,14,17)(H,15,19)