N-[2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-6-methoxy-pyrimidin-4-yl]-1-methyl-imidazole-4-sulfonamide

Systemtic Name: N-[2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-6-methoxy-pyrimidin-4-yl]-1-methyl-imidazole-4-sulfonamide Openeye Name: N-[2-[(2,3-difluorophenyl)methylsulfanyl]-6-methoxy-pyrimidin-4-yl]-1-methyl-imidazole-4-sulfonamide CAS Name: N-[2-[(2,3-difluorophenyl)methylthio]-6-methoxy-4-pyrimidinyl]-1-methyl-4-imidazolesulfonamide IUPAC Name: N-[2-[(2,3-difluorophenyl)methylsulfanyl]-6-methoxypyrimidin-4-yl]-1-methylimidazole-4-sulfonamide Traditional Name: N-[2-[(2,3-difluorobenzyl)thio]-6-methoxy-pyrimidin-4-yl]-1-methyl-imidazole-4-sulfonamide Formula: C16H15F2N5O3S2 MolecularWeight: 427.448806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)NC2=CC(=NC(=N2)SCC3=C(C(=CC=C3)F)F)OC

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)NC2=CC(=NC(=N2)SCC3=C(C(=CC=C3)F)F)OC

InChI

InChI=1S/C16H15F2N5O3S2/c1-23-7-14(19-9-23)28(24,25)22-12-6-13(26-2)21-16(20-12)27-8-10-4-3-5-11(17)15(10)18/h3-7,9H,8H2,1-2H3,(H,20,21,22)