[2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate Openeye Name: [2-[4-(difluoromethylsulfanyl)anilino]-2-oxo-ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [2-[4-(difluoromethylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(difluoromethylsulfanyl)anilino]-2-oxoethyl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [2-[4-(difluoromethylthio)anilino]-2-keto-ethyl] ester Formula: C15H13F2N3O3S MolecularWeight: 353.343826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)SC(F)F

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C15H13F2N3O3S/c1-9-6-19-12(7-18-9)14(22)23-8-13(21)20-10-2-4-11(5-3-10)24-15(16)17/h2-7,15H,8H2,1H3,(H,20,21)