N-[[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]methyl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-[[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]methyl]-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[[3-(difluoromethoxy)-4-methoxy-phenyl]methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[[3-(difluoromethoxy)-4-methoxyphenyl]methyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[[3-(difluoromethoxy)-4-methoxyphenyl]methyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[3-(difluoromethoxy)-4-methoxy-benzyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C15H14ClF2N3O3S MolecularWeight: 389.804766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=NC=C2Cl)SC)OC(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=NC=C2Cl)SC)OC(F)F

InChI

InChI=1S/C15H14ClF2N3O3S/c1-23-10-4-3-8(5-11(10)24-14(17)18)6-19-13(22)12-9(16)7-20-15(21-12)25-2/h3-5,7,14H,6H2,1-2H3,(H,19,22)