S-[2,4-bis(fluoranyl)phenyl] 3-methyl-5-(phenoxymethyl)-1,2-oxazole-4-carbothioate

Systemtic Name: S-[2,4-bis(fluoranyl)phenyl] 3-methyl-5-(phenoxymethyl)-1,2-oxazole-4-carbothioate Openeye Name: S-(2,4-difluorophenyl) 3-methyl-5-(phenoxymethyl)isoxazole-4-carbothioate CAS Name: 3-methyl-5-(phenoxymethyl)-4-isoxazolecarbothioic acid S-(2,4-difluorophenyl) ester IUPAC Name: S-(2,4-difluorophenyl) 3-methyl-5-(phenoxymethyl)-1,2-oxazole-4-carbothioate Traditional Name: 3-methyl-5-(phenoxymethyl)isoxazole-4-carbothioic acid S-(2,4-difluorophenyl) ester Formula: C18H13F2NO3S MolecularWeight: 361.362526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)SC2=C(C=C(C=C2)F)F)COC3=CC=CC=C3

Isomeric SMILES

CC1=NOC(=C1C(=O)SC2=C(C=C(C=C2)F)F)COC3=CC=CC=C3

InChI

InChI=1S/C18H13F2NO3S/c1-11-17(18(22)25-16-8-7-12(19)9-14(16)20)15(24-21-11)10-23-13-5-3-2-4-6-13/h2-9H,10H2,1H3