[4,4-bis(fluoranyl)-3-methyl-but-3-enyl] 4-methyl-2-phenylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: [4,4-bis(fluoranyl)-3-methyl-but-3-enyl] 4-methyl-2-phenylsulfanyl-pyrimidine-5-carboxylate Openeye Name: (4,4-difluoro-3-methyl-but-3-enyl) 4-methyl-2-phenylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-2-(phenylthio)-5-pyrimidinecarboxylic acid (4,4-difluoro-3-methylbut-3-enyl) ester IUPAC Name: (4,4-difluoro-3-methylbut-3-enyl) 4-methyl-2-phenylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-methyl-2-(phenylthio)pyrimidine-5-carboxylic acid (4,4-difluoro-3-methyl-but-3-enyl) ester Formula: C17H16F2N2O2S MolecularWeight: 350.382946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)OCCC(=C(F)F)C)SC2=CC=CC=C2

Isomeric SMILES

CC1=NC(=NC=C1C(=O)OCCC(=C(F)F)C)SC2=CC=CC=C2

InChI

InChI=1S/C17H16F2N2O2S/c1-11(15(18)19)8-9-23-16(22)14-10-20-17(21-12(14)2)24-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3