ethyl 4-azanyl-3-[2,4-bis(fluoranyl)phenyl]sulfanyl-benzoate

Systemtic Name: ethyl 4-azanyl-3-[2,4-bis(fluoranyl)phenyl]sulfanyl-benzoate Openeye Name: ethyl 4-amino-3-(2,4-difluorophenyl)sulfanyl-benzoate CAS Name: 4-amino-3-[(2,4-difluorophenyl)thio]benzoic acid ethyl ester IUPAC Name: ethyl 4-amino-3-(2,4-difluorophenyl)sulfanylbenzoate Traditional Name: 4-amino-3-[(2,4-difluorophenyl)thio]benzoic acid ethyl ester Formula: C15H13F2NO2S MolecularWeight: 309.331026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N)SC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N)SC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C15H13F2NO2S/c1-2-20-15(19)9-3-5-12(18)14(7-9)21-13-6-4-10(16)8-11(13)17/h3-8H,2,18H2,1H3